USER MOD reduce.3.24.130724 H: found=0, std=0, add=869, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 864 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 11 ASN : amide:sc= -1.95 K(o=-5,f=-3.3) USER MOD Set 1.2: A 13 ASN : amide:sc= -3.04 X(o=-5,f=-4.7!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -124:sc= 0 (180deg=-0.0225) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 8 THR OG1 : rot -61:sc= 1.12 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 HIS : no HD1:sc= -1.43 K(o=-1.4,f=-0.67) USER MOD Single : A 33 HIS : no HE2:sc= -0.0799 X(o=-0.08,f=-0.079) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 45 THR OG1 : rot -29:sc= 0.513 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 151:sc= 0.568 (180deg=0.0739) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.507 USER MOD Single : A 72 GLN : amide:sc= -0.913 X(o=-0.91,f=-1.2) USER MOD Single : A 73 ASN : amide:sc= -0.107 X(o=-0.11,f=-0.6) USER MOD Single : A 78 MET CE :methyl -146:sc= -0.318 (180deg=-3.82!) USER MOD Single : A 80 THR OG1 : rot -45:sc= 1 USER MOD Single : A 81 ASN : amide:sc= -0.0696 X(o=-0.07,f=-0.28) USER MOD Single : A 85 TYR OH : rot 180:sc= -0.749 USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00354) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.018 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -24:sc= 0.475 USER MOD Single : A 103 TYR OH : rot 60:sc= -0.534 USER MOD Single : A 109 GLN : amide:sc= -3.83! K(o=-3.8!,f=-4.9) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.102 -0.769 -6.245 1.00 61.02 N ATOM 2 CA MET A 1 10.902 -1.262 -5.130 1.00 1.31 C ATOM 3 C MET A 1 10.095 -2.226 -4.266 1.00 63.13 C ATOM 4 O MET A 1 9.889 -1.985 -3.077 1.00 24.31 O ATOM 5 CB MET A 1 11.403 -0.093 -4.279 1.00 20.44 C ATOM 6 CG MET A 1 12.556 0.669 -4.911 1.00 23.31 C ATOM 7 SD MET A 1 12.950 2.191 -4.028 1.00 53.04 S ATOM 8 CE MET A 1 14.739 2.174 -4.104 1.00 61.34 C ATOM 0 H1 MET A 1 10.590 -0.974 -7.140 1.00 61.02 H new ATOM 0 H2 MET A 1 9.174 -1.239 -6.241 1.00 61.02 H new ATOM 0 H3 MET A 1 9.970 0.258 -6.150 1.00 61.02 H new ATOM 0 HA MET A 1 11.758 -1.799 -5.538 1.00 1.31 H new ATOM 0 HB2 MET A 1 10.577 0.596 -4.101 1.00 20.44 H new ATOM 0 HB3 MET A 1 11.718 -0.471 -3.306 1.00 20.44 H new ATOM 0 HG2 MET A 1 13.438 0.030 -4.936 1.00 23.31 H new ATOM 0 HG3 MET A 1 12.305 0.908 -5.945 1.00 23.31 H new ATOM 0 HE1 MET A 1 15.133 3.056 -3.599 1.00 61.34 H new ATOM 0 HE2 MET A 1 15.115 1.276 -3.614 1.00 61.34 H new ATOM 0 HE3 MET A 1 15.059 2.180 -5.146 1.00 61.34 H new ATOM 18 N SER A 2 9.641 -3.318 -4.873 1.00 13.01 N ATOM 19 CA SER A 2 8.853 -4.317 -4.160 1.00 12.41 C ATOM 20 C SER A 2 9.363 -5.724 -4.455 1.00 45.41 C ATOM 21 O SER A 2 9.889 -5.993 -5.536 1.00 13.43 O ATOM 22 CB SER A 2 7.377 -4.205 -4.549 1.00 22.44 C ATOM 23 OG SER A 2 6.620 -3.610 -3.509 1.00 74.34 O ATOM 0 H SER A 2 9.805 -3.533 -5.856 1.00 13.01 H new ATOM 0 HA SER A 2 8.955 -4.129 -3.091 1.00 12.41 H new ATOM 0 HB2 SER A 2 7.281 -3.612 -5.458 1.00 22.44 H new ATOM 0 HB3 SER A 2 6.980 -5.195 -4.771 1.00 22.44 H new ATOM 0 HG SER A 2 5.681 -3.548 -3.782 1.00 74.34 H new ATOM 29 N LYS A 3 9.206 -6.619 -3.486 1.00 54.20 N ATOM 30 CA LYS A 3 9.648 -7.999 -3.640 1.00 25.54 C ATOM 31 C LYS A 3 9.101 -8.875 -2.516 1.00 45.53 C ATOM 32 O LYS A 3 8.759 -8.381 -1.443 1.00 4.52 O ATOM 33 CB LYS A 3 11.177 -8.068 -3.655 1.00 43.40 C ATOM 34 CG LYS A 3 11.737 -8.927 -4.776 1.00 15.14 C ATOM 35 CD LYS A 3 12.804 -9.881 -4.267 1.00 30.22 C ATOM 36 CE LYS A 3 13.539 -10.558 -5.414 1.00 35.43 C ATOM 37 NZ LYS A 3 14.624 -9.699 -5.962 1.00 0.23 N ATOM 0 H LYS A 3 8.775 -6.413 -2.585 1.00 54.20 H new ATOM 0 HA LYS A 3 9.263 -8.373 -4.589 1.00 25.54 H new ATOM 0 HB2 LYS A 3 11.577 -7.058 -3.748 1.00 43.40 H new ATOM 0 HB3 LYS A 3 11.524 -8.461 -2.699 1.00 43.40 H new ATOM 0 HG2 LYS A 3 10.930 -9.495 -5.238 1.00 15.14 H new ATOM 0 HG3 LYS A 3 12.160 -8.286 -5.550 1.00 15.14 H new ATOM 0 HD2 LYS A 3 13.517 -9.335 -3.649 1.00 30.22 H new ATOM 0 HD3 LYS A 3 12.344 -10.637 -3.631 1.00 30.22 H new ATOM 0 HE2 LYS A 3 13.962 -11.501 -5.068 1.00 35.43 H new ATOM 0 HE3 LYS A 3 12.831 -10.799 -6.207 1.00 35.43 H new ATOM 0 HZ1 LYS A 3 15.100 -10.196 -6.741 1.00 0.23 H new ATOM 0 HZ2 LYS A 3 14.217 -8.810 -6.316 1.00 0.23 H new ATOM 0 HZ3 LYS A 3 15.314 -9.490 -5.212 1.00 0.23 H new ATOM 51 N ASN A 4 9.023 -10.177 -2.771 1.00 43.42 N ATOM 52 CA ASN A 4 8.519 -11.120 -1.781 1.00 34.45 C ATOM 53 C ASN A 4 7.122 -10.723 -1.313 1.00 32.22 C ATOM 54 O ASN A 4 6.754 -10.952 -0.161 1.00 4.11 O ATOM 55 CB ASN A 4 9.469 -11.192 -0.583 1.00 55.42 C ATOM 56 CG ASN A 4 10.803 -11.818 -0.940 1.00 52.21 C ATOM 57 OD1 ASN A 4 11.000 -12.290 -2.060 1.00 34.32 O ATOM 58 ND2 ASN A 4 11.727 -11.824 0.013 1.00 22.13 N ATOM 0 H ASN A 4 9.303 -10.602 -3.655 1.00 43.42 H new ATOM 0 HA ASN A 4 8.461 -12.103 -2.249 1.00 34.45 H new ATOM 0 HB2 ASN A 4 9.635 -10.188 -0.193 1.00 55.42 H new ATOM 0 HB3 ASN A 4 9.001 -11.770 0.214 1.00 55.42 H new ATOM 0 HD21 ASN A 4 12.644 -12.231 -0.169 1.00 22.13 H new ATOM 0 HD22 ASN A 4 11.520 -11.421 0.927 1.00 22.13 H new ATOM 65 N GLU A 5 6.348 -10.128 -2.215 1.00 44.33 N ATOM 66 CA GLU A 5 4.992 -9.699 -1.894 1.00 42.24 C ATOM 67 C GLU A 5 4.002 -10.846 -2.075 1.00 12.42 C ATOM 68 O GLU A 5 3.030 -10.964 -1.329 1.00 12.55 O ATOM 69 CB GLU A 5 4.586 -8.516 -2.776 1.00 14.24 C ATOM 70 CG GLU A 5 4.596 -8.832 -4.262 1.00 21.12 C ATOM 71 CD GLU A 5 4.245 -7.630 -5.117 1.00 13.15 C ATOM 72 OE1 GLU A 5 5.091 -6.721 -5.239 1.00 45.43 O ATOM 73 OE2 GLU A 5 3.122 -7.599 -5.663 1.00 60.20 O ATOM 0 H GLU A 5 6.637 -9.932 -3.173 1.00 44.33 H new ATOM 0 HA GLU A 5 4.974 -9.388 -0.850 1.00 42.24 H new ATOM 0 HB2 GLU A 5 3.587 -8.187 -2.490 1.00 14.24 H new ATOM 0 HB3 GLU A 5 5.263 -7.683 -2.586 1.00 14.24 H new ATOM 0 HG2 GLU A 5 5.583 -9.199 -4.545 1.00 21.12 H new ATOM 0 HG3 GLU A 5 3.888 -9.636 -4.463 1.00 21.12 H new ATOM 80 N ARG A 6 4.256 -11.688 -3.071 1.00 11.21 N ATOM 81 CA ARG A 6 3.387 -12.824 -3.351 1.00 74.13 C ATOM 82 C ARG A 6 4.129 -13.894 -4.147 1.00 42.50 C ATOM 83 O ARG A 6 5.202 -13.641 -4.695 1.00 3.51 O ATOM 84 CB ARG A 6 2.147 -12.367 -4.123 1.00 65.23 C ATOM 85 CG ARG A 6 0.885 -13.128 -3.754 1.00 33.22 C ATOM 86 CD ARG A 6 0.488 -12.880 -2.307 1.00 54.41 C ATOM 87 NE ARG A 6 0.102 -14.112 -1.626 1.00 31.42 N ATOM 88 CZ ARG A 6 -0.339 -14.153 -0.373 1.00 40.24 C ATOM 89 NH1 ARG A 6 -0.450 -13.035 0.330 1.00 2.44 N ATOM 90 NH2 ARG A 6 -0.671 -15.314 0.177 1.00 4.44 N ATOM 0 H ARG A 6 5.057 -11.605 -3.697 1.00 11.21 H new ATOM 0 HA ARG A 6 3.076 -13.254 -2.399 1.00 74.13 H new ATOM 0 HB2 ARG A 6 1.987 -11.304 -3.940 1.00 65.23 H new ATOM 0 HB3 ARG A 6 2.331 -12.482 -5.191 1.00 65.23 H new ATOM 0 HG2 ARG A 6 0.071 -12.826 -4.413 1.00 33.22 H new ATOM 0 HG3 ARG A 6 1.043 -14.195 -3.911 1.00 33.22 H new ATOM 0 HD2 ARG A 6 1.321 -12.419 -1.777 1.00 54.41 H new ATOM 0 HD3 ARG A 6 -0.341 -12.173 -2.275 1.00 54.41 H new ATOM 0 HE ARG A 6 0.175 -14.990 -2.140 1.00 31.42 H new ATOM 0 HH11 ARG A 6 -0.197 -12.141 -0.091 1.00 2.44 H new ATOM 0 HH12 ARG A 6 -0.789 -13.069 1.292 1.00 2.44 H new ATOM 0 HH21 ARG A 6 -0.588 -16.176 -0.362 1.00 4.44 H new ATOM 0 HH22 ARG A 6 -1.009 -15.344 1.139 1.00 4.44 H new ATOM 104 N ASP A 7 3.551 -15.088 -4.206 1.00 21.15 N ATOM 105 CA ASP A 7 4.157 -16.196 -4.934 1.00 64.15 C ATOM 106 C ASP A 7 3.088 -17.130 -5.493 1.00 14.55 C ATOM 107 O ASP A 7 2.325 -17.737 -4.741 1.00 35.50 O ATOM 108 CB ASP A 7 5.107 -16.975 -4.023 1.00 72.31 C ATOM 109 CG ASP A 7 5.896 -18.029 -4.775 1.00 21.13 C ATOM 110 OD1 ASP A 7 6.323 -17.750 -5.915 1.00 23.12 O ATOM 111 OD2 ASP A 7 6.087 -19.133 -4.223 1.00 4.44 O ATOM 0 H ASP A 7 2.663 -15.314 -3.758 1.00 21.15 H new ATOM 0 HA ASP A 7 4.724 -15.782 -5.768 1.00 64.15 H new ATOM 0 HB2 ASP A 7 5.798 -16.281 -3.545 1.00 72.31 H new ATOM 0 HB3 ASP A 7 4.534 -17.453 -3.228 1.00 72.31 H new ATOM 116 N THR A 8 3.036 -17.238 -6.817 1.00 23.24 N ATOM 117 CA THR A 8 2.059 -18.095 -7.476 1.00 20.22 C ATOM 118 C THR A 8 0.636 -17.659 -7.149 1.00 14.33 C ATOM 119 O THR A 8 -0.300 -18.455 -7.220 1.00 71.33 O ATOM 120 CB THR A 8 2.238 -19.570 -7.067 1.00 45.51 C ATOM 121 OG1 THR A 8 1.449 -19.856 -5.908 1.00 34.14 O ATOM 122 CG2 THR A 8 3.700 -19.877 -6.780 1.00 23.40 C ATOM 0 H THR A 8 3.660 -16.742 -7.454 1.00 23.24 H new ATOM 0 HA THR A 8 2.228 -18.000 -8.549 1.00 20.22 H new ATOM 0 HB THR A 8 1.907 -20.197 -7.895 1.00 45.51 H new ATOM 0 HG1 THR A 8 1.741 -19.287 -5.165 1.00 34.14 H new ATOM 0 HG21 THR A 8 3.803 -20.924 -6.493 1.00 23.40 H new ATOM 0 HG22 THR A 8 4.294 -19.686 -7.674 1.00 23.40 H new ATOM 0 HG23 THR A 8 4.052 -19.242 -5.967 1.00 23.40 H new ATOM 130 N SER A 9 0.479 -16.388 -6.790 1.00 73.41 N ATOM 131 CA SER A 9 -0.831 -15.847 -6.449 1.00 14.31 C ATOM 132 C SER A 9 -1.121 -14.581 -7.250 1.00 74.11 C ATOM 133 O SER A 9 -2.024 -14.556 -8.088 1.00 4.35 O ATOM 134 CB SER A 9 -0.907 -15.544 -4.951 1.00 74.31 C ATOM 135 OG SER A 9 -1.939 -16.293 -4.331 1.00 50.55 O ATOM 0 H SER A 9 1.243 -15.715 -6.728 1.00 73.41 H new ATOM 0 HA SER A 9 -1.582 -16.596 -6.700 1.00 14.31 H new ATOM 0 HB2 SER A 9 0.048 -15.777 -4.481 1.00 74.31 H new ATOM 0 HB3 SER A 9 -1.085 -14.479 -4.801 1.00 74.31 H new ATOM 0 HG SER A 9 -1.966 -16.083 -3.374 1.00 50.55 H new ATOM 141 N PHE A 10 -0.350 -13.532 -6.987 1.00 3.13 N ATOM 142 CA PHE A 10 -0.523 -12.262 -7.682 1.00 11.44 C ATOM 143 C PHE A 10 0.775 -11.830 -8.358 1.00 11.13 C ATOM 144 O PHE A 10 1.812 -11.703 -7.709 1.00 44.51 O ATOM 145 CB PHE A 10 -0.986 -11.180 -6.703 1.00 50.13 C ATOM 146 CG PHE A 10 -2.073 -11.638 -5.774 1.00 13.02 C ATOM 147 CD1 PHE A 10 -3.127 -12.404 -6.244 1.00 35.51 C ATOM 148 CD2 PHE A 10 -2.041 -11.303 -4.430 1.00 1.41 C ATOM 149 CE1 PHE A 10 -4.130 -12.826 -5.391 1.00 24.52 C ATOM 150 CE2 PHE A 10 -3.040 -11.722 -3.572 1.00 30.12 C ATOM 151 CZ PHE A 10 -4.085 -12.486 -4.053 1.00 12.01 C ATOM 0 H PHE A 10 0.401 -13.536 -6.297 1.00 3.13 H new ATOM 0 HA PHE A 10 -1.284 -12.398 -8.450 1.00 11.44 H new ATOM 0 HB2 PHE A 10 -0.132 -10.845 -6.114 1.00 50.13 H new ATOM 0 HB3 PHE A 10 -1.341 -10.318 -7.268 1.00 50.13 H new ATOM 0 HD1 PHE A 10 -3.166 -12.675 -7.289 1.00 35.51 H new ATOM 0 HD2 PHE A 10 -1.225 -10.707 -4.048 1.00 1.41 H new ATOM 0 HE1 PHE A 10 -4.948 -13.421 -5.770 1.00 24.52 H new ATOM 0 HE2 PHE A 10 -3.004 -11.452 -2.527 1.00 30.12 H new ATOM 0 HZ PHE A 10 -4.866 -12.817 -3.384 1.00 12.01 H new ATOM 161 N ASN A 11 0.708 -11.607 -9.666 1.00 54.23 N ATOM 162 CA ASN A 11 1.877 -11.191 -10.432 1.00 1.42 C ATOM 163 C ASN A 11 1.810 -9.703 -10.762 1.00 11.54 C ATOM 164 O ASN A 11 1.270 -9.308 -11.795 1.00 51.13 O ATOM 165 CB ASN A 11 1.985 -12.006 -11.722 1.00 32.11 C ATOM 166 CG ASN A 11 3.223 -12.881 -11.751 1.00 41.01 C ATOM 167 OD1 ASN A 11 3.506 -13.608 -10.799 1.00 34.22 O ATOM 168 ND2 ASN A 11 3.969 -12.814 -12.848 1.00 11.12 N ATOM 0 H ASN A 11 -0.144 -11.707 -10.218 1.00 54.23 H new ATOM 0 HA ASN A 11 2.762 -11.371 -9.822 1.00 1.42 H new ATOM 0 HB2 ASN A 11 1.099 -12.632 -11.829 1.00 32.11 H new ATOM 0 HB3 ASN A 11 2.002 -11.329 -12.576 1.00 32.11 H new ATOM 0 HD21 ASN A 11 4.814 -13.379 -12.925 1.00 11.12 H new ATOM 0 HD22 ASN A 11 3.696 -12.197 -13.613 1.00 11.12 H new ATOM 175 N LYS A 12 2.363 -8.880 -9.876 1.00 73.33 N ATOM 176 CA LYS A 12 2.368 -7.436 -10.072 1.00 43.55 C ATOM 177 C LYS A 12 3.199 -7.056 -11.294 1.00 55.44 C ATOM 178 O LYS A 12 2.886 -6.093 -11.993 1.00 41.25 O ATOM 179 CB LYS A 12 2.920 -6.734 -8.830 1.00 11.54 C ATOM 180 CG LYS A 12 4.409 -6.948 -8.620 1.00 71.13 C ATOM 181 CD LYS A 12 5.224 -5.802 -9.197 1.00 32.41 C ATOM 182 CE LYS A 12 6.675 -5.869 -8.746 1.00 41.24 C ATOM 183 NZ LYS A 12 7.201 -4.527 -8.372 1.00 25.01 N ATOM 0 H LYS A 12 2.814 -9.190 -9.015 1.00 73.33 H new ATOM 0 HA LYS A 12 1.340 -7.114 -10.238 1.00 43.55 H new ATOM 0 HB2 LYS A 12 2.723 -5.665 -8.910 1.00 11.54 H new ATOM 0 HB3 LYS A 12 2.383 -7.092 -7.952 1.00 11.54 H new ATOM 0 HG2 LYS A 12 4.617 -7.043 -7.554 1.00 71.13 H new ATOM 0 HG3 LYS A 12 4.713 -7.884 -9.089 1.00 71.13 H new ATOM 0 HD2 LYS A 12 5.178 -5.833 -10.286 1.00 32.41 H new ATOM 0 HD3 LYS A 12 4.789 -4.852 -8.887 1.00 32.41 H new ATOM 0 HE2 LYS A 12 6.760 -6.543 -7.894 1.00 41.24 H new ATOM 0 HE3 LYS A 12 7.285 -6.288 -9.546 1.00 41.24 H new ATOM 0 HZ1 LYS A 12 8.192 -4.614 -8.070 1.00 25.01 H new ATOM 0 HZ2 LYS A 12 7.144 -3.891 -9.193 1.00 25.01 H new ATOM 0 HZ3 LYS A 12 6.635 -4.137 -7.592 1.00 25.01 H new ATOM 197 N ASN A 13 4.257 -7.820 -11.546 1.00 54.51 N ATOM 198 CA ASN A 13 5.131 -7.563 -12.685 1.00 1.13 C ATOM 199 C ASN A 13 4.341 -7.570 -13.990 1.00 21.12 C ATOM 200 O ASN A 13 4.550 -6.725 -14.859 1.00 11.52 O ATOM 201 CB ASN A 13 6.246 -8.609 -12.744 1.00 73.43 C ATOM 202 CG ASN A 13 5.707 -10.022 -12.864 1.00 13.21 C ATOM 203 OD1 ASN A 13 5.347 -10.647 -11.866 1.00 71.34 O ATOM 204 ND2 ASN A 13 5.649 -10.531 -14.089 1.00 21.21 N ATOM 0 H ASN A 13 4.530 -8.622 -10.977 1.00 54.51 H new ATOM 0 HA ASN A 13 5.575 -6.576 -12.556 1.00 1.13 H new ATOM 0 HB2 ASN A 13 6.895 -8.397 -13.594 1.00 73.43 H new ATOM 0 HB3 ASN A 13 6.860 -8.532 -11.847 1.00 73.43 H new ATOM 0 HD21 ASN A 13 5.295 -11.477 -14.232 1.00 21.21 H new ATOM 0 HD22 ASN A 13 5.958 -9.976 -14.887 1.00 21.21 H new ATOM 211 N GLY A 14 3.432 -8.531 -14.120 1.00 34.33 N ATOM 212 CA GLY A 14 2.624 -8.631 -15.321 1.00 15.30 C ATOM 213 C GLY A 14 1.796 -7.385 -15.568 1.00 12.04 C ATOM 214 O GLY A 14 1.636 -6.954 -16.710 1.00 42.22 O ATOM 0 H GLY A 14 3.241 -9.242 -13.415 1.00 34.33 H new ATOM 0 HA2 GLY A 14 3.273 -8.808 -16.178 1.00 15.30 H new ATOM 0 HA3 GLY A 14 1.962 -9.493 -15.239 1.00 15.30 H new ATOM 218 N CYS A 15 1.267 -6.806 -14.495 1.00 71.43 N ATOM 219 CA CYS A 15 0.448 -5.604 -14.601 1.00 5.42 C ATOM 220 C CYS A 15 1.297 -4.402 -15.005 1.00 20.34 C ATOM 221 O CYS A 15 0.912 -3.621 -15.876 1.00 20.22 O ATOM 222 CB CYS A 15 -0.256 -5.323 -13.273 1.00 3.44 C ATOM 223 SG CYS A 15 -2.020 -5.717 -13.275 1.00 13.02 S ATOM 0 H CYS A 15 1.391 -7.150 -13.543 1.00 71.43 H new ATOM 0 HA CYS A 15 -0.303 -5.772 -15.373 1.00 5.42 H new ATOM 0 HB2 CYS A 15 0.233 -5.898 -12.486 1.00 3.44 H new ATOM 0 HB3 CYS A 15 -0.130 -4.269 -13.023 1.00 3.44 H new ATOM 0 HG CYS A 15 -2.526 -5.448 -12.108 1.00 13.02 H new ATOM 229 N LEU A 16 2.453 -4.259 -14.365 1.00 75.21 N ATOM 230 CA LEU A 16 3.356 -3.151 -14.656 1.00 61.41 C ATOM 231 C LEU A 16 3.786 -3.169 -16.120 1.00 33.34 C ATOM 232 O LEU A 16 3.754 -2.144 -16.800 1.00 14.55 O ATOM 233 CB LEU A 16 4.587 -3.220 -13.751 1.00 11.15 C ATOM 234 CG LEU A 16 5.682 -2.189 -14.027 1.00 12.01 C ATOM 235 CD1 LEU A 16 5.315 -0.845 -13.417 1.00 44.34 C ATOM 236 CD2 LEU A 16 7.020 -2.674 -13.488 1.00 34.21 C ATOM 0 H LEU A 16 2.787 -4.896 -13.642 1.00 75.21 H new ATOM 0 HA LEU A 16 2.823 -2.220 -14.464 1.00 61.41 H new ATOM 0 HB2 LEU A 16 4.260 -3.105 -12.717 1.00 11.15 H new ATOM 0 HB3 LEU A 16 5.023 -4.215 -13.839 1.00 11.15 H new ATOM 0 HG LEU A 16 5.772 -2.063 -15.106 1.00 12.01 H new ATOM 0 HD11 LEU A 16 6.106 -0.124 -13.623 1.00 44.34 H new ATOM 0 HD12 LEU A 16 4.379 -0.492 -13.851 1.00 44.34 H new ATOM 0 HD13 LEU A 16 5.196 -0.955 -12.339 1.00 44.34 H new ATOM 0 HD21 LEU A 16 7.787 -1.928 -13.694 1.00 34.21 H new ATOM 0 HD22 LEU A 16 6.944 -2.829 -12.412 1.00 34.21 H new ATOM 0 HD23 LEU A 16 7.288 -3.613 -13.972 1.00 34.21 H new ATOM 248 N VAL A 17 4.186 -4.343 -16.599 1.00 51.43 N ATOM 249 CA VAL A 17 4.619 -4.495 -17.983 1.00 72.31 C ATOM 250 C VAL A 17 3.450 -4.323 -18.947 1.00 10.03 C ATOM 251 O VAL A 17 3.607 -3.778 -20.039 1.00 43.43 O ATOM 252 CB VAL A 17 5.266 -5.873 -18.220 1.00 3.30 C ATOM 253 CG1 VAL A 17 6.484 -6.051 -17.327 1.00 5.12 C ATOM 254 CG2 VAL A 17 4.255 -6.984 -17.984 1.00 33.10 C ATOM 0 H VAL A 17 4.219 -5.202 -16.050 1.00 51.43 H new ATOM 0 HA VAL A 17 5.359 -3.717 -18.171 1.00 72.31 H new ATOM 0 HB VAL A 17 5.595 -5.927 -19.258 1.00 3.30 H new ATOM 0 HG11 VAL A 17 6.928 -7.030 -17.508 1.00 5.12 H new ATOM 0 HG12 VAL A 17 7.215 -5.274 -17.550 1.00 5.12 H new ATOM 0 HG13 VAL A 17 6.183 -5.977 -16.282 1.00 5.12 H new ATOM 0 HG21 VAL A 17 4.729 -7.950 -18.156 1.00 33.10 H new ATOM 0 HG22 VAL A 17 3.894 -6.935 -16.957 1.00 33.10 H new ATOM 0 HG23 VAL A 17 3.416 -6.864 -18.670 1.00 33.10 H new ATOM 264 N PHE A 18 2.277 -4.791 -18.535 1.00 35.15 N ATOM 265 CA PHE A 18 1.080 -4.689 -19.361 1.00 73.35 C ATOM 266 C PHE A 18 0.765 -3.232 -19.686 1.00 45.14 C ATOM 267 O PHE A 18 0.613 -2.863 -20.851 1.00 4.41 O ATOM 268 CB PHE A 18 -0.113 -5.334 -18.652 1.00 3.14 C ATOM 269 CG PHE A 18 -1.396 -5.235 -19.426 1.00 31.23 C ATOM 270 CD1 PHE A 18 -1.636 -6.072 -20.504 1.00 13.22 C ATOM 271 CD2 PHE A 18 -2.362 -4.306 -19.075 1.00 34.31 C ATOM 272 CE1 PHE A 18 -2.816 -5.982 -21.218 1.00 71.31 C ATOM 273 CE2 PHE A 18 -3.544 -4.212 -19.785 1.00 74.54 C ATOM 274 CZ PHE A 18 -3.772 -5.052 -20.858 1.00 22.52 C ATOM 0 H PHE A 18 2.130 -5.245 -17.634 1.00 35.15 H new ATOM 0 HA PHE A 18 1.269 -5.219 -20.295 1.00 73.35 H new ATOM 0 HB2 PHE A 18 0.110 -6.385 -18.466 1.00 3.14 H new ATOM 0 HB3 PHE A 18 -0.247 -4.860 -17.680 1.00 3.14 H new ATOM 0 HD1 PHE A 18 -0.893 -6.802 -20.789 1.00 13.22 H new ATOM 0 HD2 PHE A 18 -2.189 -3.647 -18.237 1.00 34.31 H new ATOM 0 HE1 PHE A 18 -2.991 -6.639 -22.057 1.00 71.31 H new ATOM 0 HE2 PHE A 18 -4.289 -3.483 -19.501 1.00 74.54 H new ATOM 0 HZ PHE A 18 -4.695 -4.982 -21.414 1.00 22.52 H new ATOM 284 N VAL A 19 0.669 -2.408 -18.648 1.00 11.21 N ATOM 285 CA VAL A 19 0.373 -0.991 -18.821 1.00 43.34 C ATOM 286 C VAL A 19 1.529 -0.268 -19.505 1.00 13.02 C ATOM 287 O VAL A 19 1.317 0.604 -20.347 1.00 44.41 O ATOM 288 CB VAL A 19 0.082 -0.309 -17.471 1.00 42.34 C ATOM 289 CG1 VAL A 19 -1.182 -0.878 -16.847 1.00 75.10 C ATOM 290 CG2 VAL A 19 1.267 -0.463 -16.530 1.00 65.14 C ATOM 0 H VAL A 19 0.792 -2.697 -17.678 1.00 11.21 H new ATOM 0 HA VAL A 19 -0.515 -0.928 -19.450 1.00 43.34 H new ATOM 0 HB VAL A 19 -0.076 0.755 -17.648 1.00 42.34 H new ATOM 0 HG11 VAL A 19 -1.371 -0.384 -15.894 1.00 75.10 H new ATOM 0 HG12 VAL A 19 -2.026 -0.710 -17.517 1.00 75.10 H new ATOM 0 HG13 VAL A 19 -1.057 -1.948 -16.682 1.00 75.10 H new ATOM 0 HG21 VAL A 19 1.044 0.025 -15.581 1.00 65.14 H new ATOM 0 HG22 VAL A 19 1.459 -1.522 -16.357 1.00 65.14 H new ATOM 0 HG23 VAL A 19 2.148 -0.002 -16.976 1.00 65.14 H new ATOM 300 N SER A 20 2.751 -0.637 -19.136 1.00 63.35 N ATOM 301 CA SER A 20 3.942 -0.022 -19.712 1.00 14.14 C ATOM 302 C SER A 20 3.948 -0.167 -21.230 1.00 41.24 C ATOM 303 O SER A 20 4.193 0.797 -21.956 1.00 12.32 O ATOM 304 CB SER A 20 5.204 -0.654 -19.122 1.00 71.11 C ATOM 305 OG SER A 20 5.734 0.144 -18.078 1.00 44.24 O ATOM 0 H SER A 20 2.943 -1.359 -18.441 1.00 63.35 H new ATOM 0 HA SER A 20 3.928 1.040 -19.466 1.00 14.14 H new ATOM 0 HB2 SER A 20 4.972 -1.649 -18.742 1.00 71.11 H new ATOM 0 HB3 SER A 20 5.952 -0.778 -19.905 1.00 71.11 H new ATOM 0 HG SER A 20 6.539 -0.283 -17.717 1.00 44.24 H new ATOM 311 N ARG A 21 3.678 -1.379 -21.704 1.00 14.21 N ATOM 312 CA ARG A 21 3.653 -1.652 -23.136 1.00 4.41 C ATOM 313 C ARG A 21 2.528 -0.879 -23.818 1.00 10.24 C ATOM 314 O ARG A 21 2.685 -0.390 -24.937 1.00 64.12 O ATOM 315 CB ARG A 21 3.483 -3.151 -23.388 1.00 53.32 C ATOM 316 CG ARG A 21 4.796 -3.885 -23.606 1.00 54.04 C ATOM 317 CD ARG A 21 5.541 -4.095 -22.297 1.00 54.04 C ATOM 318 NE ARG A 21 6.989 -4.049 -22.479 1.00 30.14 N ATOM 319 CZ ARG A 21 7.685 -2.920 -22.554 1.00 73.03 C ATOM 320 NH1 ARG A 21 7.068 -1.750 -22.465 1.00 13.14 N ATOM 321 NH2 ARG A 21 9.001 -2.960 -22.720 1.00 33.03 N ATOM 0 H ARG A 21 3.473 -2.188 -21.117 1.00 14.21 H new ATOM 0 HA ARG A 21 4.603 -1.325 -23.559 1.00 4.41 H new ATOM 0 HB2 ARG A 21 2.964 -3.597 -22.540 1.00 53.32 H new ATOM 0 HB3 ARG A 21 2.847 -3.294 -24.262 1.00 53.32 H new ATOM 0 HG2 ARG A 21 4.601 -4.850 -24.074 1.00 54.04 H new ATOM 0 HG3 ARG A 21 5.421 -3.317 -24.295 1.00 54.04 H new ATOM 0 HD2 ARG A 21 5.241 -3.329 -21.582 1.00 54.04 H new ATOM 0 HD3 ARG A 21 5.260 -5.058 -21.870 1.00 54.04 H new ATOM 0 HE ARG A 21 7.494 -4.932 -22.553 1.00 30.14 H new ATOM 0 HH11 ARG A 21 6.056 -1.715 -22.339 1.00 13.14 H new ATOM 0 HH12 ARG A 21 7.605 -0.885 -22.523 1.00 13.14 H new ATOM 0 HH21 ARG A 21 9.479 -3.858 -22.790 1.00 33.03 H new ATOM 0 HH22 ARG A 21 9.534 -2.092 -22.777 1.00 33.03 H new ATOM 335 N LEU A 22 1.393 -0.773 -23.136 1.00 12.22 N ATOM 336 CA LEU A 22 0.240 -0.060 -23.675 1.00 40.22 C ATOM 337 C LEU A 22 0.585 1.399 -23.958 1.00 22.23 C ATOM 338 O LEU A 22 0.276 1.924 -25.027 1.00 50.02 O ATOM 339 CB LEU A 22 -0.935 -0.138 -22.699 1.00 52.12 C ATOM 340 CG LEU A 22 -1.980 -1.216 -22.991 1.00 42.33 C ATOM 341 CD1 LEU A 22 -2.324 -1.983 -21.724 1.00 63.23 C ATOM 342 CD2 LEU A 22 -3.230 -0.596 -23.598 1.00 14.24 C ATOM 0 H LEU A 22 1.246 -1.172 -22.209 1.00 12.22 H new ATOM 0 HA LEU A 22 -0.043 -0.536 -24.614 1.00 40.22 H new ATOM 0 HB2 LEU A 22 -0.539 -0.306 -21.698 1.00 52.12 H new ATOM 0 HB3 LEU A 22 -1.435 0.830 -22.686 1.00 52.12 H new ATOM 0 HG LEU A 22 -1.560 -1.917 -23.712 1.00 42.33 H new ATOM 0 HD11 LEU A 22 -3.069 -2.746 -21.951 1.00 63.23 H new ATOM 0 HD12 LEU A 22 -1.425 -2.459 -21.332 1.00 63.23 H new ATOM 0 HD13 LEU A 22 -2.725 -1.295 -20.980 1.00 63.23 H new ATOM 0 HD21 LEU A 22 -3.963 -1.377 -23.799 1.00 14.24 H new ATOM 0 HD22 LEU A 22 -3.653 0.127 -22.901 1.00 14.24 H new ATOM 0 HD23 LEU A 22 -2.971 -0.093 -24.530 1.00 14.24 H new ATOM 354 N TRP A 23 1.229 2.046 -22.993 1.00 50.12 N ATOM 355 CA TRP A 23 1.618 3.444 -23.139 1.00 44.14 C ATOM 356 C TRP A 23 2.463 3.646 -24.393 1.00 21.24 C ATOM 357 O TRP A 23 2.350 4.667 -25.071 1.00 74.31 O ATOM 358 CB TRP A 23 2.394 3.910 -21.906 1.00 51.52 C ATOM 359 CG TRP A 23 1.538 4.051 -20.684 1.00 54.12 C ATOM 360 CD1 TRP A 23 0.195 4.296 -20.648 1.00 75.23 C ATOM 361 CD2 TRP A 23 1.967 3.957 -19.322 1.00 10.34 C ATOM 362 NE1 TRP A 23 -0.237 4.360 -19.345 1.00 60.23 N ATOM 363 CE2 TRP A 23 0.831 4.155 -18.512 1.00 71.43 C ATOM 364 CE3 TRP A 23 3.200 3.724 -18.706 1.00 73.13 C ATOM 365 CZ2 TRP A 23 0.894 4.126 -17.122 1.00 11.32 C ATOM 366 CZ3 TRP A 23 3.261 3.696 -17.326 1.00 54.50 C ATOM 367 CH2 TRP A 23 2.114 3.896 -16.546 1.00 72.10 C ATOM 0 H TRP A 23 1.493 1.625 -22.102 1.00 50.12 H new ATOM 0 HA TRP A 23 0.710 4.040 -23.235 1.00 44.14 H new ATOM 0 HB2 TRP A 23 3.195 3.200 -21.700 1.00 51.52 H new ATOM 0 HB3 TRP A 23 2.866 4.868 -22.123 1.00 51.52 H new ATOM 0 HD1 TRP A 23 -0.435 4.421 -21.516 1.00 75.23 H new ATOM 0 HE1 TRP A 23 -1.197 4.532 -19.047 1.00 60.23 H new ATOM 0 HE3 TRP A 23 4.089 3.569 -19.299 1.00 73.13 H new ATOM 0 HZ2 TRP A 23 0.011 4.280 -16.519 1.00 11.32 H new ATOM 0 HZ3 TRP A 23 4.209 3.517 -16.840 1.00 54.50 H new ATOM 0 HH2 TRP A 23 2.194 3.868 -15.469 1.00 72.10 H new ATOM 378 N ASP A 24 3.309 2.667 -24.694 1.00 42.12 N ATOM 379 CA ASP A 24 4.172 2.737 -25.868 1.00 3.14 C ATOM 380 C ASP A 24 3.379 2.467 -27.142 1.00 43.25 C ATOM 381 O ASP A 24 3.645 3.060 -28.189 1.00 41.00 O ATOM 382 CB ASP A 24 5.320 1.733 -25.744 1.00 13.43 C ATOM 383 CG ASP A 24 6.677 2.379 -25.938 1.00 44.24 C ATOM 384 OD1 ASP A 24 6.861 3.080 -26.956 1.00 62.31 O ATOM 385 OD2 ASP A 24 7.556 2.185 -25.073 1.00 30.13 O ATOM 0 H ASP A 24 3.416 1.816 -24.142 1.00 42.12 H new ATOM 0 HA ASP A 24 4.585 3.744 -25.925 1.00 3.14 H new ATOM 0 HB2 ASP A 24 5.282 1.262 -24.762 1.00 13.43 H new ATOM 0 HB3 ASP A 24 5.188 0.942 -26.482 1.00 13.43 H new ATOM 390 N LEU A 25 2.406 1.569 -27.048 1.00 75.41 N ATOM 391 CA LEU A 25 1.574 1.219 -28.194 1.00 74.23 C ATOM 392 C LEU A 25 0.785 2.429 -28.685 1.00 5.12 C ATOM 393 O LEU A 25 0.808 2.758 -29.871 1.00 30.10 O ATOM 394 CB LEU A 25 0.614 0.086 -27.826 1.00 71.00 C ATOM 395 CG LEU A 25 -0.564 -0.131 -28.776 1.00 71.34 C ATOM 396 CD1 LEU A 25 -0.077 -0.651 -30.120 1.00 31.50 C ATOM 397 CD2 LEU A 25 -1.573 -1.092 -28.164 1.00 60.23 C ATOM 0 H LEU A 25 2.173 1.069 -26.190 1.00 75.41 H new ATOM 0 HA LEU A 25 2.230 0.885 -28.998 1.00 74.23 H new ATOM 0 HB2 LEU A 25 1.184 -0.841 -27.768 1.00 71.00 H new ATOM 0 HB3 LEU A 25 0.219 0.281 -26.829 1.00 71.00 H new ATOM 0 HG LEU A 25 -1.057 0.828 -28.937 1.00 71.34 H new ATOM 0 HD11 LEU A 25 -0.929 -0.800 -30.783 1.00 31.50 H new ATOM 0 HD12 LEU A 25 0.607 0.073 -30.564 1.00 31.50 H new ATOM 0 HD13 LEU A 25 0.441 -1.599 -29.977 1.00 31.50 H new ATOM 0 HD21 LEU A 25 -2.405 -1.235 -28.854 1.00 60.23 H new ATOM 0 HD22 LEU A 25 -1.092 -2.051 -27.972 1.00 60.23 H new ATOM 0 HD23 LEU A 25 -1.946 -0.679 -27.227 1.00 60.23 H new ATOM 409 N ASP A 26 0.091 3.089 -27.764 1.00 43.03 N ATOM 410 CA ASP A 26 -0.701 4.265 -28.102 1.00 54.51 C ATOM 411 C ASP A 26 0.189 5.494 -28.261 1.00 64.44 C ATOM 412 O ASP A 26 0.484 6.191 -27.290 1.00 62.52 O ATOM 413 CB ASP A 26 -1.757 4.522 -27.025 1.00 60.14 C ATOM 414 CG ASP A 26 -1.240 4.239 -25.629 1.00 2.14 C ATOM 415 OD1 ASP A 26 -0.228 4.855 -25.235 1.00 44.42 O ATOM 416 OD2 ASP A 26 -1.847 3.401 -24.929 1.00 63.01 O ATOM 0 H ASP A 26 0.061 2.829 -26.778 1.00 43.03 H new ATOM 0 HA ASP A 26 -1.200 4.075 -29.052 1.00 54.51 H new ATOM 0 HB2 ASP A 26 -2.087 5.559 -27.084 1.00 60.14 H new ATOM 0 HB3 ASP A 26 -2.630 3.898 -27.220 1.00 60.14 H new ATOM 421 N LYS A 27 0.616 5.753 -29.493 1.00 23.34 N ATOM 422 CA LYS A 27 1.474 6.896 -29.781 1.00 14.42 C ATOM 423 C LYS A 27 0.840 8.191 -29.282 1.00 74.00 C ATOM 424 O LYS A 27 1.539 9.139 -28.924 1.00 4.23 O ATOM 425 CB LYS A 27 1.741 6.993 -31.285 1.00 0.45 C ATOM 426 CG LYS A 27 3.204 6.819 -31.655 1.00 33.33 C ATOM 427 CD LYS A 27 3.592 7.703 -32.828 1.00 14.55 C ATOM 428 CE LYS A 27 5.024 8.200 -32.701 1.00 72.14 C ATOM 429 NZ LYS A 27 5.822 7.908 -33.924 1.00 53.14 N ATOM 0 H LYS A 27 0.381 5.186 -30.308 1.00 23.34 H new ATOM 0 HA LYS A 27 2.420 6.750 -29.259 1.00 14.42 H new ATOM 0 HB2 LYS A 27 1.152 6.234 -31.800 1.00 0.45 H new ATOM 0 HB3 LYS A 27 1.397 7.962 -31.645 1.00 0.45 H new ATOM 0 HG2 LYS A 27 3.829 7.060 -30.795 1.00 33.33 H new ATOM 0 HG3 LYS A 27 3.395 5.776 -31.906 1.00 33.33 H new ATOM 0 HD2 LYS A 27 3.480 7.145 -33.758 1.00 14.55 H new ATOM 0 HD3 LYS A 27 2.914 8.554 -32.883 1.00 14.55 H new ATOM 0 HE2 LYS A 27 5.021 9.274 -32.517 1.00 72.14 H new ATOM 0 HE3 LYS A 27 5.496 7.730 -31.838 1.00 72.14 H new ATOM 0 HZ1 LYS A 27 6.792 8.262 -33.798 1.00 53.14 H new ATOM 0 HZ2 LYS A 27 5.847 6.881 -34.086 1.00 53.14 H new ATOM 0 HZ3 LYS A 27 5.386 8.377 -34.743 1.00 53.14 H new ATOM 443 N LEU A 28 -0.488 8.224 -29.260 1.00 33.20 N ATOM 444 CA LEU A 28 -1.217 9.402 -28.803 1.00 50.11 C ATOM 445 C LEU A 28 -0.959 9.662 -27.322 1.00 72.53 C ATOM 446 O LEU A 28 -1.057 10.795 -26.854 1.00 34.11 O ATOM 447 CB LEU A 28 -2.717 9.225 -29.048 1.00 44.32 C ATOM 448 CG LEU A 28 -3.558 8.863 -27.824 1.00 75.53 C ATOM 449 CD1 LEU A 28 -4.011 10.119 -27.096 1.00 61.32 C ATOM 450 CD2 LEU A 28 -4.758 8.020 -28.233 1.00 23.51 C ATOM 0 H LEU A 28 -1.082 7.448 -29.553 1.00 33.20 H new ATOM 0 HA LEU A 28 -0.861 10.262 -29.371 1.00 50.11 H new ATOM 0 HB2 LEU A 28 -3.107 10.150 -29.472 1.00 44.32 H new ATOM 0 HB3 LEU A 28 -2.853 8.448 -29.800 1.00 44.32 H new ATOM 0 HG LEU A 28 -2.941 8.277 -27.143 1.00 75.53 H new ATOM 0 HD11 LEU A 28 -4.608 9.841 -26.228 1.00 61.32 H new ATOM 0 HD12 LEU A 28 -3.139 10.685 -26.770 1.00 61.32 H new ATOM 0 HD13 LEU A 28 -4.611 10.732 -27.768 1.00 61.32 H new ATOM 0 HD21 LEU A 28 -5.346 7.771 -27.350 1.00 23.51 H new ATOM 0 HD22 LEU A 28 -5.376 8.582 -28.933 1.00 23.51 H new ATOM 0 HD23 LEU A 28 -4.413 7.102 -28.709 1.00 23.51 H new ATOM 462 N GLY A 29 -0.627 8.603 -26.590 1.00 63.41 N ATOM 463 CA GLY A 29 -0.358 8.737 -25.170 1.00 44.24 C ATOM 464 C GLY A 29 -1.587 8.482 -24.321 1.00 24.23 C ATOM 465 O GLY A 29 -1.727 7.413 -23.726 1.00 51.43 O ATOM 0 H GLY A 29 -0.539 7.655 -26.955 1.00 63.41 H new ATOM 0 HA2 GLY A 29 0.428 8.038 -24.885 1.00 44.24 H new ATOM 0 HA3 GLY A 29 0.018 9.740 -24.968 1.00 44.24 H new ATOM 469 N MET A 30 -2.478 9.466 -24.262 1.00 31.45 N ATOM 470 CA MET A 30 -3.701 9.342 -23.477 1.00 73.22 C ATOM 471 C MET A 30 -4.694 8.409 -24.163 1.00 35.23 C ATOM 472 O MET A 30 -5.696 8.855 -24.722 1.00 51.23 O ATOM 473 CB MET A 30 -4.338 10.717 -23.265 1.00 60.34 C ATOM 474 CG MET A 30 -5.580 10.683 -22.389 1.00 63.12 C ATOM 475 SD MET A 30 -6.668 12.092 -22.673 1.00 34.03 S ATOM 476 CE MET A 30 -6.587 12.908 -21.080 1.00 53.14 C ATOM 0 H MET A 30 -2.377 10.357 -24.748 1.00 31.45 H new ATOM 0 HA MET A 30 -3.440 8.917 -22.508 1.00 73.22 H new ATOM 0 HB2 MET A 30 -3.603 11.383 -22.813 1.00 60.34 H new ATOM 0 HB3 MET A 30 -4.599 11.141 -24.235 1.00 60.34 H new ATOM 0 HG2 MET A 30 -6.129 9.761 -22.579 1.00 63.12 H new ATOM 0 HG3 MET A 30 -5.281 10.665 -21.341 1.00 63.12 H new ATOM 0 HE1 MET A 30 -7.211 13.802 -21.097 1.00 53.14 H new ATOM 0 HE2 MET A 30 -6.945 12.230 -20.305 1.00 53.14 H new ATOM 0 HE3 MET A 30 -5.556 13.190 -20.867 1.00 53.14 H new ATOM 486 N PHE A 31 -4.410 7.111 -24.115 1.00 53.54 N ATOM 487 CA PHE A 31 -5.278 6.116 -24.733 1.00 72.32 C ATOM 488 C PHE A 31 -5.653 5.026 -23.733 1.00 75.02 C ATOM 489 O PHE A 31 -4.788 4.325 -23.208 1.00 20.21 O ATOM 490 CB PHE A 31 -4.590 5.493 -25.949 1.00 71.44 C ATOM 491 CG PHE A 31 -5.546 4.857 -26.918 1.00 65.05 C ATOM 492 CD1 PHE A 31 -6.673 5.538 -27.347 1.00 74.14 C ATOM 493 CD2 PHE A 31 -5.316 3.578 -27.400 1.00 50.20 C ATOM 494 CE1 PHE A 31 -7.554 4.956 -28.239 1.00 55.04 C ATOM 495 CE2 PHE A 31 -6.193 2.991 -28.292 1.00 52.44 C ATOM 496 CZ PHE A 31 -7.314 3.681 -28.712 1.00 34.44 C ATOM 0 H PHE A 31 -3.586 6.724 -23.655 1.00 53.54 H new ATOM 0 HA PHE A 31 -6.190 6.617 -25.057 1.00 72.32 H new ATOM 0 HB2 PHE A 31 -4.018 6.263 -26.467 1.00 71.44 H new ATOM 0 HB3 PHE A 31 -3.877 4.742 -25.608 1.00 71.44 H new ATOM 0 HD1 PHE A 31 -6.866 6.535 -26.980 1.00 74.14 H new ATOM 0 HD2 PHE A 31 -4.441 3.034 -27.075 1.00 50.20 H new ATOM 0 HE1 PHE A 31 -8.429 5.498 -28.566 1.00 55.04 H new ATOM 0 HE2 PHE A 31 -6.002 1.994 -28.661 1.00 52.44 H new ATOM 0 HZ PHE A 31 -8.001 3.224 -29.409 1.00 34.44 H new ATOM 506 N HIS A 32 -6.950 4.890 -23.474 1.00 71.11 N ATOM 507 CA HIS A 32 -7.441 3.886 -22.537 1.00 73.31 C ATOM 508 C HIS A 32 -8.966 3.879 -22.498 1.00 15.34 C ATOM 509 O HIS A 32 -9.571 4.055 -21.439 1.00 51.33 O ATOM 510 CB HIS A 32 -6.884 4.148 -21.138 1.00 34.05 C ATOM 511 CG HIS A 32 -6.936 5.589 -20.733 1.00 2.02 C ATOM 512 ND1 HIS A 32 -5.834 6.417 -20.757 1.00 3.32 N ATOM 513 CD2 HIS A 32 -7.966 6.349 -20.294 1.00 12.04 C ATOM 514 CE1 HIS A 32 -6.184 7.624 -20.348 1.00 65.03 C ATOM 515 NE2 HIS A 32 -7.473 7.609 -20.062 1.00 2.35 N ATOM 0 H HIS A 32 -7.679 5.462 -23.900 1.00 71.11 H new ATOM 0 HA HIS A 32 -7.100 2.909 -22.878 1.00 73.31 H new ATOM 0 HB2 HIS A 32 -7.445 3.556 -20.416 1.00 34.05 H new ATOM 0 HB3 HIS A 32 -5.850 3.805 -21.097 1.00 34.05 H new ATOM 0 HD2 HIS A 32 -8.986 6.025 -20.152 1.00 12.04 H new ATOM 0 HE1 HIS A 32 -5.528 8.477 -20.262 1.00 65.03 H new ATOM 0 HE2 HIS A 32 -8.014 8.404 -19.724 1.00 2.35 H new ATOM 523 N HIS A 33 -9.583 3.676 -23.658 1.00 1.23 N ATOM 524 CA HIS A 33 -11.038 3.647 -23.756 1.00 1.25 C ATOM 525 C HIS A 33 -11.486 2.798 -24.941 1.00 61.12 C ATOM 526 O HIS A 33 -10.773 2.648 -25.933 1.00 45.24 O ATOM 527 CB HIS A 33 -11.589 5.067 -23.893 1.00 33.32 C ATOM 528 CG HIS A 33 -11.334 5.681 -25.234 1.00 44.44 C ATOM 529 ND1 HIS A 33 -12.301 6.355 -25.950 1.00 43.21 N ATOM 530 CD2 HIS A 33 -10.211 5.723 -25.990 1.00 12.13 C ATOM 531 CE1 HIS A 33 -11.785 6.783 -27.088 1.00 43.14 C ATOM 532 NE2 HIS A 33 -10.518 6.413 -27.137 1.00 23.02 N ATOM 0 H HIS A 33 -9.098 3.529 -24.543 1.00 1.23 H new ATOM 0 HA HIS A 33 -11.430 3.200 -22.843 1.00 1.25 H new ATOM 0 HB2 HIS A 33 -12.663 5.051 -23.708 1.00 33.32 H new ATOM 0 HB3 HIS A 33 -11.143 5.697 -23.123 1.00 33.32 H new ATOM 0 HD1 HIS A 33 -13.264 6.500 -25.648 1.00 43.21 H new ATOM 0 HD2 HIS A 33 -9.253 5.294 -25.738 1.00 12.13 H new ATOM 0 HE1 HIS A 33 -12.310 7.341 -27.849 1.00 43.14 H new ATOM 540 N PRO A 34 -12.695 2.227 -24.838 1.00 14.33 N ATOM 541 CA PRO A 34 -13.265 1.383 -25.892 1.00 52.20 C ATOM 542 C PRO A 34 -13.640 2.183 -27.135 1.00 75.42 C ATOM 543 O PRO A 34 -14.009 3.354 -27.045 1.00 23.22 O ATOM 544 CB PRO A 34 -14.517 0.794 -25.237 1.00 51.20 C ATOM 545 CG PRO A 34 -14.892 1.779 -24.184 1.00 32.44 C ATOM 546 CD PRO A 34 -13.600 2.363 -23.684 1.00 20.23 C ATOM 0 HA PRO A 34 -12.556 0.632 -26.241 1.00 52.20 H new ATOM 0 HB2 PRO A 34 -15.320 0.665 -25.963 1.00 51.20 H new ATOM 0 HB3 PRO A 34 -14.315 -0.187 -24.807 1.00 51.20 H new ATOM 0 HG2 PRO A 34 -15.540 2.556 -24.589 1.00 32.44 H new ATOM 0 HG3 PRO A 34 -15.441 1.296 -23.375 1.00 32.44 H new ATOM 0 HD2 PRO A 34 -13.718 3.405 -23.387 1.00 20.23 H new ATOM 0 HD3 PRO A 34 -13.225 1.824 -22.814 1.00 20.23 H new ATOM 554 N VAL A 35 -13.545 1.542 -28.296 1.00 51.11 N ATOM 555 CA VAL A 35 -13.876 2.193 -29.558 1.00 12.31 C ATOM 556 C VAL A 35 -15.379 2.417 -29.683 1.00 71.12 C ATOM 557 O VAL A 35 -16.179 1.599 -29.229 1.00 62.53 O ATOM 558 CB VAL A 35 -13.389 1.365 -30.762 1.00 34.13 C ATOM 559 CG1 VAL A 35 -13.959 -0.044 -30.706 1.00 21.44 C ATOM 560 CG2 VAL A 35 -13.767 2.050 -32.067 1.00 22.43 C ATOM 0 H VAL A 35 -13.242 0.573 -28.388 1.00 51.11 H new ATOM 0 HA VAL A 35 -13.367 3.157 -29.560 1.00 12.31 H new ATOM 0 HB VAL A 35 -12.302 1.294 -30.717 1.00 34.13 H new ATOM 0 HG11 VAL A 35 -13.604 -0.614 -31.564 1.00 21.44 H new ATOM 0 HG12 VAL A 35 -13.634 -0.532 -29.787 1.00 21.44 H new ATOM 0 HG13 VAL A 35 -15.048 0.003 -30.726 1.00 21.44 H new ATOM 0 HG21 VAL A 35 -13.415 1.451 -32.907 1.00 22.43 H new ATOM 0 HG22 VAL A 35 -14.851 2.153 -32.123 1.00 22.43 H new ATOM 0 HG23 VAL A 35 -13.306 3.037 -32.107 1.00 22.43 H new ATOM 570 N SER A 36 -15.756 3.531 -30.303 1.00 35.34 N ATOM 571 CA SER A 36 -17.164 3.864 -30.485 1.00 52.42 C ATOM 572 C SER A 36 -17.765 3.072 -31.643 1.00 4.24 C ATOM 573 O SER A 36 -17.118 2.865 -32.669 1.00 1.30 O ATOM 574 CB SER A 36 -17.326 5.364 -30.741 1.00 2.13 C ATOM 575 OG SER A 36 -16.735 6.125 -29.701 1.00 50.14 O ATOM 0 H SER A 36 -15.107 4.217 -30.687 1.00 35.34 H new ATOM 0 HA SER A 36 -17.695 3.598 -29.571 1.00 52.42 H new ATOM 0 HB2 SER A 36 -16.866 5.625 -31.694 1.00 2.13 H new ATOM 0 HB3 SER A 36 -18.385 5.611 -30.820 1.00 2.13 H new ATOM 0 HG SER A 36 -16.850 7.080 -29.888 1.00 50.14 H new ATOM 581 N ALA A 37 -19.006 2.631 -31.469 1.00 12.45 N ATOM 582 CA ALA A 37 -19.696 1.864 -32.498 1.00 63.31 C ATOM 583 C ALA A 37 -19.811 2.661 -33.793 1.00 13.34 C ATOM 584 O ALA A 37 -19.750 2.099 -34.886 1.00 12.35 O ATOM 585 CB ALA A 37 -21.074 1.444 -32.009 1.00 52.34 C ATOM 0 H ALA A 37 -19.555 2.792 -30.624 1.00 12.45 H new ATOM 0 HA ALA A 37 -19.108 0.969 -32.704 1.00 63.31 H new ATOM 0 HB1 ALA A 37 -21.578 0.872 -32.788 1.00 52.34 H new ATOM 0 HB2 ALA A 37 -20.971 0.828 -31.116 1.00 52.34 H new ATOM 0 HB3 ALA A 37 -21.662 2.331 -31.772 1.00 52.34 H new ATOM 591 N GLU A 38 -19.979 3.973 -33.661 1.00 12.51 N ATOM 592 CA GLU A 38 -20.105 4.847 -34.822 1.00 0.14 C ATOM 593 C GLU A 38 -18.964 4.610 -35.807 1.00 75.33 C ATOM 594 O GLU A 38 -19.169 4.612 -37.021 1.00 12.43 O ATOM 595 CB GLU A 38 -20.119 6.314 -34.385 1.00 33.51 C ATOM 596 CG GLU A 38 -18.854 6.746 -33.663 1.00 32.12 C ATOM 597 CD GLU A 38 -19.077 7.947 -32.765 1.00 2.41 C ATOM 598 OE1 GLU A 38 -18.933 9.088 -33.252 1.00 74.14 O ATOM 599 OE2 GLU A 38 -19.395 7.746 -31.574 1.00 2.31 O ATOM 0 H GLU A 38 -20.031 4.454 -32.763 1.00 12.51 H new ATOM 0 HA GLU A 38 -21.047 4.614 -35.319 1.00 0.14 H new ATOM 0 HB2 GLU A 38 -20.260 6.945 -35.263 1.00 33.51 H new ATOM 0 HB3 GLU A 38 -20.975 6.482 -33.732 1.00 33.51 H new ATOM 0 HG2 GLU A 38 -18.479 5.915 -33.066 1.00 32.12 H new ATOM 0 HG3 GLU A 38 -18.084 6.984 -34.397 1.00 32.12 H new ATOM 606 N GLU A 39 -17.763 4.405 -35.276 1.00 13.44 N ATOM 607 CA GLU A 39 -16.590 4.168 -36.109 1.00 12.15 C ATOM 608 C GLU A 39 -16.378 2.674 -36.337 1.00 12.24 C ATOM 609 O GLU A 39 -15.850 2.261 -37.370 1.00 5.14 O ATOM 610 CB GLU A 39 -15.345 4.778 -35.461 1.00 34.03 C ATOM 611 CG GLU A 39 -15.553 6.197 -34.960 1.00 13.32 C ATOM 612 CD GLU A 39 -14.251 6.884 -34.595 1.00 74.13 C ATOM 613 OE1 GLU A 39 -13.481 7.221 -35.518 1.00 43.53 O ATOM 614 OE2 GLU A 39 -14.003 7.083 -33.388 1.00 0.50 O ATOM 0 H GLU A 39 -17.577 4.398 -34.273 1.00 13.44 H new ATOM 0 HA GLU A 39 -16.759 4.645 -37.074 1.00 12.15 H new ATOM 0 HB2 GLU A 39 -15.035 4.149 -34.627 1.00 34.03 H new ATOM 0 HB3 GLU A 39 -14.530 4.773 -36.184 1.00 34.03 H new ATOM 0 HG2 GLU A 39 -16.063 6.778 -35.728 1.00 13.32 H new ATOM 0 HG3 GLU A 39 -16.206 6.178 -34.088 1.00 13.32 H new ATOM 621 N LEU A 40 -16.793 1.869 -35.365 1.00 75.22 N ATOM 622 CA LEU A 40 -16.649 0.420 -35.458 1.00 52.14 C ATOM 623 C LEU A 40 -17.941 -0.283 -35.053 1.00 4.14 C ATOM 624 O LEU A 40 -18.068 -0.812 -33.948 1.00 63.02 O ATOM 625 CB LEU A 40 -15.496 -0.055 -34.573 1.00 33.43 C ATOM 626 CG LEU A 40 -14.884 -1.408 -34.937 1.00 21.31 C ATOM 627 CD1 LEU A 40 -14.352 -1.387 -36.362 1.00 32.44 C ATOM 628 CD2 LEU A 40 -13.778 -1.774 -33.958 1.00 44.11 C ATOM 0 H LEU A 40 -17.232 2.195 -34.504 1.00 75.22 H new ATOM 0 HA LEU A 40 -16.430 0.167 -36.495 1.00 52.14 H new ATOM 0 HB2 LEU A 40 -14.708 0.697 -34.603 1.00 33.43 H new ATOM 0 HB3 LEU A 40 -15.851 -0.104 -33.544 1.00 33.43 H new ATOM 0 HG LEU A 40 -15.664 -2.167 -34.873 1.00 21.31 H new ATOM 0 HD11 LEU A 40 -13.920 -2.358 -36.603 1.00 32.44 H new ATOM 0 HD12 LEU A 40 -15.168 -1.171 -37.052 1.00 32.44 H new ATOM 0 HD13 LEU A 40 -13.586 -0.617 -36.453 1.00 32.44 H new ATOM 0 HD21 LEU A 40 -13.354 -2.740 -34.233 1.00 44.11 H new ATOM 0 HD22 LEU A 40 -12.998 -1.013 -33.989 1.00 44.11 H new ATOM 0 HD23 LEU A 40 -14.189 -1.831 -32.950 1.00 44.11 H new ATOM 640 N PRO A 41 -18.922 -0.292 -35.967 1.00 13.34 N ATOM 641 CA PRO A 41 -20.221 -0.929 -35.728 1.00 24.03 C ATOM 642 C PRO A 41 -20.120 -2.450 -35.678 1.00 44.35 C ATOM 643 O PRO A 41 -21.032 -3.127 -35.204 1.00 4.12 O ATOM 644 CB PRO A 41 -21.059 -0.487 -36.930 1.00 30.51 C ATOM 645 CG PRO A 41 -20.064 -0.205 -38.002 1.00 52.12 C ATOM 646 CD PRO A 41 -18.840 0.319 -37.304 1.00 12.52 C ATOM 0 HA PRO A 41 -20.646 -0.641 -34.766 1.00 24.03 H new ATOM 0 HB2 PRO A 41 -21.758 -1.267 -37.234 1.00 30.51 H new ATOM 0 HB3 PRO A 41 -21.651 0.398 -36.696 1.00 30.51 H new ATOM 0 HG2 PRO A 41 -19.834 -1.108 -38.568 1.00 52.12 H new ATOM 0 HG3 PRO A 41 -20.452 0.526 -38.712 1.00 52.12 H new ATOM 0 HD2 PRO A 41 -17.926 0.029 -37.823 1.00 12.52 H new ATOM 0 HD3 PRO A 41 -18.844 1.408 -37.249 1.00 12.52 H new ATOM 654 N ASP A 42 -19.006 -2.980 -36.171 1.00 63.10 N ATOM 655 CA ASP A 42 -18.785 -4.422 -36.182 1.00 1.44 C ATOM 656 C ASP A 42 -17.653 -4.805 -35.233 1.00 50.04 C ATOM 657 O ASP A 42 -17.068 -5.882 -35.352 1.00 13.00 O ATOM 658 CB ASP A 42 -18.464 -4.899 -37.599 1.00 22.54 C ATOM 659 CG ASP A 42 -17.031 -4.605 -37.998 1.00 72.40 C ATOM 660 OD1 ASP A 42 -16.487 -3.578 -37.542 1.00 43.11 O ATOM 661 OD2 ASP A 42 -16.454 -5.403 -38.766 1.00 32.32 O ATOM 0 H ASP A 42 -18.242 -2.433 -36.568 1.00 63.10 H new ATOM 0 HA ASP A 42 -19.699 -4.908 -35.842 1.00 1.44 H new ATOM 0 HB2 ASP A 42 -18.644 -5.972 -37.668 1.00 22.54 H new ATOM 0 HB3 ASP A 42 -19.141 -4.416 -38.304 1.00 22.54 H new ATOM 666 N TYR A 43 -17.349 -3.916 -34.294 1.00 62.50 N ATOM 667 CA TYR A 43 -16.285 -4.160 -33.328 1.00 25.14 C ATOM 668 C TYR A 43 -16.474 -5.507 -32.636 1.00 14.40 C ATOM 669 O TYR A 43 -15.505 -6.191 -32.306 1.00 41.25 O ATOM 670 CB TYR A 43 -16.246 -3.040 -32.286 1.00 74.24 C ATOM 671 CG TYR A 43 -17.377 -3.106 -31.285 1.00 22.25 C ATOM 672 CD1 TYR A 43 -18.683 -2.822 -31.662 1.00 14.13 C ATOM 673 CD2 TYR A 43 -17.138 -3.454 -29.961 1.00 12.15 C ATOM 674 CE1 TYR A 43 -19.719 -2.880 -30.749 1.00 70.24 C ATOM 675 CE2 TYR A 43 -18.168 -3.516 -29.042 1.00 21.24 C ATOM 676 CZ TYR A 43 -19.456 -3.228 -29.441 1.00 14.03 C ATOM 677 OH TYR A 43 -20.485 -3.289 -28.529 1.00 55.42 O ATOM 0 H TYR A 43 -17.824 -3.020 -34.181 1.00 62.50 H new ATOM 0 HA TYR A 43 -15.338 -4.179 -33.867 1.00 25.14 H new ATOM 0 HB2 TYR A 43 -15.297 -3.084 -31.752 1.00 74.24 H new ATOM 0 HB3 TYR A 43 -16.280 -2.078 -32.797 1.00 74.24 H new ATOM 0 HD1 TYR A 43 -18.893 -2.551 -32.686 1.00 14.13 H new ATOM 0 HD2 TYR A 43 -16.130 -3.680 -29.645 1.00 12.15 H new ATOM 0 HE1 TYR A 43 -20.729 -2.654 -31.058 1.00 70.24 H new ATOM 0 HE2 TYR A 43 -17.965 -3.789 -28.017 1.00 21.24 H new ATOM 0 HH TYR A 43 -20.131 -3.550 -27.653 1.00 55.42 H new ATOM 687 N HIS A 44 -17.731 -5.881 -32.419 1.00 72.34 N ATOM 688 CA HIS A 44 -18.050 -7.147 -31.768 1.00 54.31 C ATOM 689 C HIS A 44 -17.601 -8.327 -32.624 1.00 51.13 C ATOM 690 O HIS A 44 -17.118 -9.335 -32.108 1.00 5.25 O ATOM 691 CB HIS A 44 -19.552 -7.241 -31.497 1.00 52.42 C ATOM 692 CG HIS A 44 -19.886 -7.910 -30.200 1.00 30.23 C ATOM 693 ND1 HIS A 44 -20.237 -9.240 -30.108 1.00 34.42 N ATOM 694 CD2 HIS A 44 -19.919 -7.426 -28.936 1.00 40.32 C ATOM 695 CE1 HIS A 44 -20.474 -9.545 -28.844 1.00 43.22 C ATOM 696 NE2 HIS A 44 -20.287 -8.461 -28.113 1.00 30.04 N ATOM 0 H HIS A 44 -18.545 -5.326 -32.684 1.00 72.34 H new ATOM 0 HA HIS A 44 -17.514 -7.184 -30.820 1.00 54.31 H new ATOM 0 HB2 HIS A 44 -19.977 -6.237 -31.498 1.00 52.42 H new ATOM 0 HB3 HIS A 44 -20.026 -7.789 -32.311 1.00 52.42 H new ATOM 0 HD2 HIS A 44 -19.697 -6.414 -28.632 1.00 40.32 H new ATOM 0 HE1 HIS A 44 -20.770 -10.515 -28.472 1.00 43.22 H new ATOM 0 HE2 HIS A 44 -20.398 -8.402 -27.101 1.00 30.04 H new ATOM 704 N THR A 45 -17.765 -8.196 -33.937 1.00 42.22 N ATOM 705 CA THR A 45 -17.378 -9.251 -34.865 1.00 33.32 C ATOM 706 C THR A 45 -15.909 -9.132 -35.253 1.00 1.44 C ATOM 707 O THR A 45 -15.340 -10.040 -35.858 1.00 31.43 O ATOM 708 CB THR A 45 -18.239 -9.220 -36.142 1.00 42.40 C ATOM 709 OG1 THR A 45 -17.920 -8.059 -36.919 1.00 33.53 O ATOM 710 CG2 THR A 45 -19.720 -9.214 -35.796 1.00 52.34 C ATOM 0 H THR A 45 -18.164 -7.369 -34.382 1.00 42.22 H new ATOM 0 HA THR A 45 -17.539 -10.198 -34.350 1.00 33.32 H new ATOM 0 HB THR A 45 -18.022 -10.117 -36.723 1.00 42.40 H new ATOM 0 HG1 THR A 45 -17.617 -7.341 -36.325 1.00 33.53 H new ATOM 0 HG21 THR A 45 -20.308 -9.192 -36.714 1.00 52.34 H new ATOM 0 HG22 THR A 45 -19.965 -10.112 -35.230 1.00 52.34 H new ATOM 0 HG23 THR A 45 -19.950 -8.333 -35.196 1.00 52.34 H new ATOM 718 N VAL A 46 -15.298 -8.005 -34.900 1.00 14.32 N ATOM 719 CA VAL A 46 -13.894 -7.767 -35.210 1.00 24.04 C ATOM 720 C VAL A 46 -12.994 -8.218 -34.064 1.00 54.20 C ATOM 721 O VAL A 46 -12.052 -8.984 -34.266 1.00 43.12 O ATOM 722 CB VAL A 46 -13.627 -6.278 -35.501 1.00 73.34 C ATOM 723 CG1 VAL A 46 -12.151 -6.046 -35.786 1.00 54.54 C ATOM 724 CG2 VAL A 46 -14.485 -5.802 -36.664 1.00 61.11 C ATOM 0 H VAL A 46 -15.754 -7.243 -34.399 1.00 14.32 H new ATOM 0 HA VAL A 46 -13.664 -8.351 -36.101 1.00 24.04 H new ATOM 0 HB VAL A 46 -13.897 -5.698 -34.618 1.00 73.34 H new ATOM 0 HG11 VAL A 46 -11.982 -4.989 -35.989 1.00 54.54 H new ATOM 0 HG12 VAL A 46 -11.561 -6.348 -34.920 1.00 54.54 H new ATOM 0 HG13 VAL A 46 -11.851 -6.635 -36.653 1.00 54.54 H new ATOM 0 HG21 VAL A 46 -14.284 -4.748 -36.857 1.00 61.11 H new ATOM 0 HG22 VAL A 46 -14.248 -6.385 -37.554 1.00 61.11 H new ATOM 0 HG23 VAL A 46 -15.538 -5.931 -36.416 1.00 61.11 H new ATOM 734 N ILE A 47 -13.292 -7.738 -32.861 1.00 73.13 N ATOM 735 CA ILE A 47 -12.512 -8.093 -31.683 1.00 24.22 C ATOM 736 C ILE A 47 -13.382 -8.770 -30.630 1.00 74.30 C ATOM 737 O ILE A 47 -12.909 -9.606 -29.860 1.00 63.21 O ATOM 738 CB ILE A 47 -11.840 -6.856 -31.059 1.00 2.13 C ATOM 739 CG1 ILE A 47 -12.856 -5.723 -30.899 1.00 43.14 C ATOM 740 CG2 ILE A 47 -10.664 -6.404 -31.912 1.00 71.33 C ATOM 741 CD1 ILE A 47 -12.272 -4.469 -30.286 1.00 63.50 C ATOM 0 H ILE A 47 -14.068 -7.102 -32.677 1.00 73.13 H new ATOM 0 HA ILE A 47 -11.740 -8.788 -32.014 1.00 24.22 H new ATOM 0 HB ILE A 47 -11.465 -7.124 -30.072 1.00 2.13 H new ATOM 0 HG12 ILE A 47 -13.273 -5.480 -31.876 1.00 43.14 H new ATOM 0 HG13 ILE A 47 -13.681 -6.071 -30.278 1.00 43.14 H new ATOM 0 HG21 ILE A 47 -10.200 -5.529 -31.457 1.00 71.33 H new ATOM 0 HG22 ILE A 47 -9.932 -7.209 -31.979 1.00 71.33 H new ATOM 0 HG23 ILE A 47 -11.016 -6.150 -32.912 1.00 71.33 H new ATOM 0 HD11 ILE A 47 -13.049 -3.709 -30.203 1.00 63.50 H new ATOM 0 HD12 ILE A 47 -11.880 -4.697 -29.295 1.00 63.50 H new ATOM 0 HD13 ILE A 47 -11.466 -4.096 -30.918 1.00 63.50 H new ATOM 753 N LYS A 48 -14.660 -8.405 -30.603 1.00 23.22 N ATOM 754 CA LYS A 48 -15.600 -8.979 -29.647 1.00 43.31 C ATOM 755 C LYS A 48 -15.368 -8.413 -28.250 1.00 13.33 C ATOM 756 O LYS A 48 -16.256 -7.788 -27.668 1.00 64.30 O ATOM 757 CB LYS A 48 -15.465 -10.503 -29.620 1.00 53.12 C ATOM 758 CG LYS A 48 -16.796 -11.230 -29.535 1.00 55.52 C ATOM 759 CD LYS A 48 -16.695 -12.645 -30.078 1.00 23.22 C ATOM 760 CE LYS A 48 -17.056 -12.704 -31.554 1.00 51.41 C ATOM 761 NZ LYS A 48 -18.349 -13.407 -31.781 1.00 40.22 N ATOM 0 H LYS A 48 -15.068 -7.714 -31.233 1.00 23.22 H new ATOM 0 HA LYS A 48 -16.609 -8.715 -29.964 1.00 43.31 H new ATOM 0 HB2 LYS A 48 -14.939 -10.829 -30.518 1.00 53.12 H new ATOM 0 HB3 LYS A 48 -14.849 -10.790 -28.768 1.00 53.12 H new ATOM 0 HG2 LYS A 48 -17.129 -11.261 -28.498 1.00 55.52 H new ATOM 0 HG3 LYS A 48 -17.550 -10.677 -30.096 1.00 55.52 H new ATOM 0 HD2 LYS A 48 -15.681 -13.019 -29.935 1.00 23.22 H new ATOM 0 HD3 LYS A 48 -17.359 -13.300 -29.514 1.00 23.22 H new ATOM 0 HE2 LYS A 48 -17.118 -11.692 -31.953 1.00 51.41 H new ATOM 0 HE3 LYS A 48 -16.264 -13.215 -32.101 1.00 51.41 H new ATOM 0 HZ1 LYS A 48 -18.560 -13.426 -32.799 1.00 40.22 H new ATOM 0 HZ2 LYS A 48 -18.282 -14.381 -31.423 1.00 40.22 H new ATOM 0 HZ3 LYS A 48 -19.110 -12.905 -31.280 1.00 40.22 H new ATOM 775 N ARG A 49 -14.171 -8.634 -27.717 1.00 42.15 N ATOM 776 CA ARG A 49 -13.823 -8.145 -26.389 1.00 33.45 C ATOM 777 C ARG A 49 -12.877 -6.951 -26.478 1.00 74.43 C ATOM 778 O ARG A 49 -11.661 -7.099 -26.595 1.00 62.42 O ATOM 779 CB ARG A 49 -13.177 -9.261 -25.565 1.00 11.33 C ATOM 780 CG ARG A 49 -13.836 -9.479 -24.213 1.00 20.05 C ATOM 781 CD ARG A 49 -14.918 -10.545 -24.285 1.00 65.55 C ATOM 782 NE ARG A 49 -14.387 -11.834 -24.724 1.00 54.43 N ATOM 783 CZ ARG A 49 -15.139 -12.801 -25.239 1.00 3.24 C ATOM 784 NH1 ARG A 49 -16.446 -12.626 -25.378 1.00 64.42 N ATOM 785 NH2 ARG A 49 -14.583 -13.945 -25.615 1.00 23.41 N ATOM 0 H ARG A 49 -13.425 -9.149 -28.185 1.00 42.15 H new ATOM 0 HA ARG A 49 -14.740 -7.823 -25.897 1.00 33.45 H new ATOM 0 HB2 ARG A 49 -13.217 -10.190 -26.133 1.00 11.33 H new ATOM 0 HB3 ARG A 49 -12.124 -9.025 -25.413 1.00 11.33 H new ATOM 0 HG2 ARG A 49 -13.082 -9.773 -23.483 1.00 20.05 H new ATOM 0 HG3 ARG A 49 -14.270 -8.542 -23.863 1.00 20.05 H new ATOM 0 HD2 ARG A 49 -15.381 -10.658 -23.305 1.00 65.55 H new ATOM 0 HD3 ARG A 49 -15.700 -10.222 -24.972 1.00 65.55 H new ATOM 0 HE ARG A 49 -13.385 -12.000 -24.630 1.00 54.43 H new ATOM 0 HH11 ARG A 49 -16.876 -11.747 -25.089 1.00 64.42 H new ATOM 0 HH12 ARG A 49 -17.021 -13.370 -25.774 1.00 64.42 H new ATOM 0 HH21 ARG A 49 -13.578 -14.083 -25.509 1.00 23.41 H new ATOM 0 HH22 ARG A 49 -15.161 -14.687 -26.010 1.00 23.41 H new ATOM 799 N PRO A 50 -13.448 -5.739 -26.423 1.00 41.32 N ATOM 800 CA PRO A 50 -12.674 -4.496 -26.497 1.00 11.25 C ATOM 801 C PRO A 50 -11.830 -4.264 -25.248 1.00 15.33 C ATOM 802 O PRO A 50 -11.689 -5.152 -24.408 1.00 31.53 O ATOM 803 CB PRO A 50 -13.751 -3.415 -26.623 1.00 45.13 C ATOM 804 CG PRO A 50 -14.963 -4.013 -25.999 1.00 35.05 C ATOM 805 CD PRO A 50 -14.892 -5.488 -26.284 1.00 52.45 C ATOM 0 HA PRO A 50 -11.963 -4.507 -27.323 1.00 11.25 H new ATOM 0 HB2 PRO A 50 -13.454 -2.499 -26.112 1.00 45.13 H new ATOM 0 HB3 PRO A 50 -13.930 -3.155 -27.666 1.00 45.13 H new ATOM 0 HG2 PRO A 50 -14.983 -3.824 -24.926 1.00 35.05 H new ATOM 0 HG3 PRO A 50 -15.871 -3.578 -26.416 1.00 35.05 H new ATOM 0 HD2 PRO A 50 -15.326 -6.075 -25.475 1.00 52.45 H new ATOM 0 HD3 PRO A 50 -15.435 -5.748 -27.193 1.00 52.45 H new ATOM 813 N VAL A 51 -11.272 -3.063 -25.131 1.00 63.13 N ATOM 814 CA VAL A 51 -10.443 -2.714 -23.984 1.00 10.43 C ATOM 815 C VAL A 51 -10.855 -1.368 -23.398 1.00 13.13 C ATOM 816 O VAL A 51 -11.003 -0.383 -24.122 1.00 31.15 O ATOM 817 CB VAL A 51 -8.951 -2.660 -24.364 1.00 74.20 C ATOM 818 CG1 VAL A 51 -8.721 -1.655 -25.482 1.00 41.10 C ATOM 819 CG2 VAL A 51 -8.104 -2.321 -23.147 1.00 43.24 C ATOM 0 H VAL A 51 -11.379 -2.316 -25.817 1.00 63.13 H new ATOM 0 HA VAL A 51 -10.592 -3.494 -23.237 1.00 10.43 H new ATOM 0 HB VAL A 51 -8.649 -3.643 -24.725 1.00 74.20 H new ATOM 0 HG11 VAL A 51 -7.662 -1.631 -25.737 1.00 41.10 H new ATOM 0 HG12 VAL A 51 -9.299 -1.948 -26.359 1.00 41.10 H new ATOM 0 HG13 VAL A 51 -9.038 -0.665 -25.153 1.00 41.10 H new ATOM 0 HG21 VAL A 51 -7.053 -2.287 -23.433 1.00 43.24 H new ATOM 0 HG22 VAL A 51 -8.405 -1.350 -22.754 1.00 43.24 H new ATOM 0 HG23 VAL A 51 -8.247 -3.083 -22.381 1.00 43.24 H new ATOM 829 N ASP A 52 -11.039 -1.333 -22.083 1.00 30.25 N ATOM 830 CA ASP A 52 -11.433 -0.107 -21.398 1.00 21.43 C ATOM 831 C ASP A 52 -10.656 0.061 -20.096 1.00 10.43 C ATOM 832 O ASP A 52 -10.189 -0.915 -19.508 1.00 64.11 O ATOM 833 CB ASP A 52 -12.935 -0.118 -21.112 1.00 14.12 C ATOM 834 CG ASP A 52 -13.377 1.077 -20.290 1.00 2.20 C ATOM 835 OD1 ASP A 52 -12.938 2.205 -20.599 1.00 23.00 O ATOM 836 OD2 ASP A 52 -14.162 0.885 -19.338 1.00 61.14 O ATOM 0 H ASP A 52 -10.922 -2.140 -21.470 1.00 30.25 H new ATOM 0 HA ASP A 52 -11.201 0.735 -22.050 1.00 21.43 H new ATOM 0 HB2 ASP A 52 -13.481 -0.129 -22.055 1.00 14.12 H new ATOM 0 HB3 ASP A 52 -13.194 -1.035 -20.583 1.00 14.12 H new ATOM 841 N LEU A 53 -10.521 1.306 -19.651 1.00 22.33 N ATOM 842 CA LEU A 53 -9.799 1.603 -18.418 1.00 53.22 C ATOM 843 C LEU A 53 -10.604 1.168 -17.198 1.00 22.24 C ATOM 844 O LEU A 53 -10.062 0.579 -16.262 1.00 43.41 O ATOM 845 CB LEU A 53 -9.491 3.099 -18.333 1.00 0.11 C ATOM 846 CG LEU A 53 -8.494 3.518 -17.252 1.00 44.33 C ATOM 847 CD1 LEU A 53 -7.086 3.078 -17.625 1.00 35.22 C ATOM 848 CD2 LEU A 53 -8.543 5.024 -17.036 1.00 34.33 C ATOM 0 H LEU A 53 -10.902 2.125 -20.125 1.00 22.33 H new ATOM 0 HA LEU A 53 -8.863 1.045 -18.430 1.00 53.22 H new ATOM 0 HB2 LEU A 53 -9.107 3.426 -19.299 1.00 0.11 H new ATOM 0 HB3 LEU A 53 -10.426 3.633 -18.164 1.00 0.11 H new ATOM 0 HG LEU A 53 -8.772 3.027 -16.319 1.00 44.33 H new ATOM 0 HD11 LEU A 53 -6.390 3.385 -16.844 1.00 35.22 H new ATOM 0 HD12 LEU A 53 -7.059 1.993 -17.729 1.00 35.22 H new ATOM 0 HD13 LEU A 53 -6.798 3.540 -18.569 1.00 35.22 H new ATOM 0 HD21 LEU A 53 -7.827 5.304 -16.263 1.00 34.33 H new ATOM 0 HD22 LEU A 53 -8.291 5.533 -17.966 1.00 34.33 H new ATOM 0 HD23 LEU A 53 -9.546 5.314 -16.724 1.00 34.33 H new ATOM 860 N SER A 54 -11.900 1.459 -17.215 1.00 55.31 N ATOM 861 CA SER A 54 -12.780 1.099 -16.109 1.00 41.40 C ATOM 862 C SER A 54 -12.932 -0.415 -16.007 1.00 33.21 C ATOM 863 O SER A 54 -12.989 -0.972 -14.911 1.00 13.15 O ATOM 864 CB SER A 54 -14.153 1.751 -16.288 1.00 63.45 C ATOM 865 OG SER A 54 -14.465 2.593 -15.192 1.00 61.43 O ATOM 0 H SER A 54 -12.365 1.943 -17.983 1.00 55.31 H new ATOM 0 HA SER A 54 -12.331 1.464 -15.186 1.00 41.40 H new ATOM 0 HB2 SER A 54 -14.166 2.331 -17.211 1.00 63.45 H new ATOM 0 HB3 SER A 54 -14.916 0.979 -16.386 1.00 63.45 H new ATOM 0 HG SER A 54 -15.346 2.999 -15.332 1.00 61.43 H new ATOM 871 N SER A 55 -12.998 -1.076 -17.158 1.00 42.03 N ATOM 872 CA SER A 55 -13.148 -2.526 -17.200 1.00 44.11 C ATOM 873 C SER A 55 -11.977 -3.213 -16.504 1.00 63.23 C ATOM 874 O SER A 55 -12.170 -4.082 -15.653 1.00 2.31 O ATOM 875 CB SER A 55 -13.249 -3.008 -18.649 1.00 1.24 C ATOM 876 OG SER A 55 -13.473 -4.406 -18.706 1.00 42.15 O ATOM 0 H SER A 55 -12.950 -0.630 -18.074 1.00 42.03 H new ATOM 0 HA SER A 55 -14.066 -2.787 -16.673 1.00 44.11 H new ATOM 0 HB2 SER A 55 -14.061 -2.485 -19.154 1.00 1.24 H new ATOM 0 HB3 SER A 55 -12.331 -2.761 -19.183 1.00 1.24 H new ATOM 0 HG SER A 55 -13.535 -4.689 -19.642 1.00 42.15 H new ATOM 882 N ILE A 56 -10.763 -2.818 -16.873 1.00 61.01 N ATOM 883 CA ILE A 56 -9.561 -3.395 -16.284 1.00 44.53 C ATOM 884 C ILE A 56 -9.388 -2.946 -14.837 1.00 31.50 C ATOM 885 O ILE A 56 -9.124 -3.760 -13.952 1.00 34.42 O ATOM 886 CB ILE A 56 -8.302 -3.008 -17.083 1.00 63.20 C ATOM 887 CG1 ILE A 56 -8.409 -3.516 -18.522 1.00 42.25 C ATOM 888 CG2 ILE A 56 -7.056 -3.565 -16.410 1.00 70.44 C ATOM 889 CD1 ILE A 56 -7.341 -2.962 -19.439 1.00 42.15 C ATOM 0 H ILE A 56 -10.586 -2.101 -17.577 1.00 61.01 H new ATOM 0 HA ILE A 56 -9.683 -4.478 -16.314 1.00 44.53 H new ATOM 0 HB ILE A 56 -8.224 -1.921 -17.106 1.00 63.20 H new ATOM 0 HG12 ILE A 56 -8.346 -4.604 -18.520 1.00 42.25 H new ATOM 0 HG13 ILE A 56 -9.390 -3.254 -18.919 1.00 42.25 H new ATOM 0 HG21 ILE A 56 -6.175 -3.283 -16.986 1.00 70.44 H new ATOM 0 HG22 ILE A 56 -6.975 -3.160 -15.401 1.00 70.44 H new ATOM 0 HG23 ILE A 56 -7.125 -4.652 -16.360 1.00 70.44 H new ATOM 0 HD11 ILE A 56 -7.478 -3.365 -20.443 1.00 42.15 H new ATOM 0 HD12 ILE A 56 -7.417 -1.875 -19.471 1.00 42.15 H new ATOM 0 HD13 ILE A 56 -6.357 -3.246 -19.065 1.00 42.15 H new ATOM 901 N ARG A 57 -9.540 -1.647 -14.603 1.00 75.04 N ATOM 902 CA ARG A 57 -9.402 -1.090 -13.263 1.00 72.31 C ATOM 903 C ARG A 57 -10.304 -1.823 -12.274 1.00 60.43 C ATOM 904 O ARG A 57 -9.913 -2.082 -11.136 1.00 64.20 O ATOM 905 CB ARG A 57 -9.741 0.401 -13.270 1.00 14.41 C ATOM 906 CG ARG A 57 -9.493 1.089 -11.937 1.00 71.51 C ATOM 907 CD ARG A 57 -10.724 1.036 -11.045 1.00 62.04 C ATOM 908 NE ARG A 57 -11.264 2.366 -10.779 1.00 3.51 N ATOM 909 CZ ARG A 57 -10.650 3.271 -10.025 1.00 3.24 C ATOM 910 NH1 ARG A 57 -9.481 2.990 -9.466 1.00 22.05 N ATOM 911 NH2 ARG A 57 -11.205 4.460 -9.829 1.00 3.44 N ATOM 0 H ARG A 57 -9.759 -0.960 -15.325 1.00 75.04 H new ATOM 0 HA ARG A 57 -8.366 -1.219 -12.948 1.00 72.31 H new ATOM 0 HB2 ARG A 57 -9.149 0.896 -14.040 1.00 14.41 H new ATOM 0 HB3 ARG A 57 -10.789 0.525 -13.544 1.00 14.41 H new ATOM 0 HG2 ARG A 57 -8.654 0.611 -11.430 1.00 71.51 H new ATOM 0 HG3 ARG A 57 -9.212 2.128 -12.109 1.00 71.51 H new ATOM 0 HD2 ARG A 57 -11.490 0.422 -11.520 1.00 62.04 H new ATOM 0 HD3 ARG A 57 -10.468 0.553 -10.102 1.00 62.04 H new ATOM 0 HE ARG A 57 -12.162 2.614 -11.195 1.00 3.51 H new ATOM 0 HH11 ARG A 57 -9.051 2.077 -9.615 1.00 22.05 H new ATOM 0 HH12 ARG A 57 -9.012 3.687 -8.888 1.00 22.05 H new ATOM 0 HH21 ARG A 57 -12.104 4.680 -10.257 1.00 3.44 H new ATOM 0 HH22 ARG A 57 -10.733 5.154 -9.250 1.00 3.44 H new ATOM 925 N ASP A 58 -11.512 -2.154 -12.717 1.00 31.34 N ATOM 926 CA ASP A 58 -12.470 -2.858 -11.871 1.00 44.11 C ATOM 927 C ASP A 58 -12.052 -4.312 -11.671 1.00 55.42 C ATOM 928 O ASP A 58 -12.228 -4.876 -10.592 1.00 54.22 O ATOM 929 CB ASP A 58 -13.868 -2.796 -12.487 1.00 12.20 C ATOM 930 CG ASP A 58 -14.936 -3.334 -11.555 1.00 2.23 C ATOM 931 OD1 ASP A 58 -14.708 -3.330 -10.327 1.00 32.15 O ATOM 932 OD2 ASP A 58 -15.999 -3.758 -12.053 1.00 52.30 O ATOM 0 H ASP A 58 -11.851 -1.947 -13.656 1.00 31.34 H new ATOM 0 HA ASP A 58 -12.488 -2.367 -10.898 1.00 44.11 H new ATOM 0 HB2 ASP A 58 -14.102 -1.763 -12.746 1.00 12.20 H new ATOM 0 HB3 ASP A 58 -13.879 -3.367 -13.415 1.00 12.20 H new ATOM 937 N GLY A 59 -11.499 -4.913 -12.720 1.00 74.12 N ATOM 938 CA GLY A 59 -11.067 -6.296 -12.640 1.00 31.14 C ATOM 939 C GLY A 59 -9.995 -6.508 -11.589 1.00 60.22 C ATOM 940 O GLY A 59 -10.085 -7.430 -10.778 1.00 72.32 O ATOM 0 H GLY A 59 -11.342 -4.467 -13.624 1.00 74.12 H new ATOM 0 HA2 GLY A 59 -11.925 -6.929 -12.413 1.00 31.14 H new ATOM 0 HA3 GLY A 59 -10.687 -6.612 -13.612 1.00 31.14 H new ATOM 944 N ILE A 60 -8.977 -5.654 -11.604 1.00 71.34 N ATOM 945 CA ILE A 60 -7.883 -5.753 -10.646 1.00 71.52 C ATOM 946 C ILE A 60 -8.363 -5.450 -9.231 1.00 1.01 C ATOM 947 O ILE A 60 -7.957 -6.108 -8.274 1.00 11.15 O ATOM 948 CB ILE A 60 -6.733 -4.793 -11.003 1.00 72.34 C ATOM 949 CG1 ILE A 60 -5.952 -5.324 -12.208 1.00 13.44 C ATOM 950 CG2 ILE A 60 -5.811 -4.604 -9.808 1.00 64.25 C ATOM 951 CD1 ILE A 60 -6.497 -4.851 -13.537 1.00 55.20 C ATOM 0 H ILE A 60 -8.887 -4.886 -12.269 1.00 71.34 H new ATOM 0 HA ILE A 60 -7.516 -6.778 -10.691 1.00 71.52 H new ATOM 0 HB ILE A 60 -7.156 -3.824 -11.267 1.00 72.34 H new ATOM 0 HG12 ILE A 60 -4.910 -5.015 -12.121 1.00 13.44 H new ATOM 0 HG13 ILE A 60 -5.964 -6.414 -12.187 1.00 13.44 H new ATOM 0 HG21 ILE A 60 -5.003 -3.923 -10.076 1.00 64.25 H new ATOM 0 HG22 ILE A 60 -6.376 -4.187 -8.975 1.00 64.25 H new ATOM 0 HG23 ILE A 60 -5.392 -5.567 -9.516 1.00 64.25 H new ATOM 0 HD11 ILE A 60 -5.895 -5.266 -14.346 1.00 55.20 H new ATOM 0 HD12 ILE A 60 -7.529 -5.183 -13.646 1.00 55.20 H new ATOM 0 HD13 ILE A 60 -6.460 -3.762 -13.579 1.00 55.20 H new ATOM 963 N GLU A 61 -9.230 -4.450 -9.107 1.00 74.25 N ATOM 964 CA GLU A 61 -9.766 -4.061 -7.808 1.00 52.35 C ATOM 965 C GLU A 61 -10.582 -5.195 -7.194 1.00 43.21 C ATOM 966 O GLU A 61 -10.576 -5.392 -5.979 1.00 3.12 O ATOM 967 CB GLU A 61 -10.635 -2.809 -7.945 1.00 53.21 C ATOM 968 CG GLU A 61 -11.426 -2.477 -6.691 1.00 0.13 C ATOM 969 CD GLU A 61 -11.342 -1.009 -6.319 1.00 64.22 C ATOM 970 OE1 GLU A 61 -12.172 -0.222 -6.821 1.00 65.20 O ATOM 971 OE2 GLU A 61 -10.446 -0.647 -5.527 1.00 74.55 O ATOM 0 H GLU A 61 -9.576 -3.895 -9.890 1.00 74.25 H new ATOM 0 HA GLU A 61 -8.927 -3.842 -7.148 1.00 52.35 H new ATOM 0 HB2 GLU A 61 -9.998 -1.961 -8.198 1.00 53.21 H new ATOM 0 HB3 GLU A 61 -11.327 -2.947 -8.775 1.00 53.21 H new ATOM 0 HG2 GLU A 61 -12.470 -2.750 -6.842 1.00 0.13 H new ATOM 0 HG3 GLU A 61 -11.055 -3.080 -5.862 1.00 0.13 H new ATOM 978 N LYS A 62 -11.284 -5.938 -8.043 1.00 2.12 N ATOM 979 CA LYS A 62 -12.105 -7.053 -7.586 1.00 64.01 C ATOM 980 C LYS A 62 -11.243 -8.274 -7.283 1.00 22.53 C ATOM 981 O LYS A 62 -11.624 -9.133 -6.488 1.00 63.24 O ATOM 982 CB LYS A 62 -13.155 -7.406 -8.642 1.00 23.22 C ATOM 983 CG LYS A 62 -14.151 -6.291 -8.905 1.00 55.21 C ATOM 984 CD LYS A 62 -14.807 -6.439 -10.268 1.00 11.02 C ATOM 985 CE LYS A 62 -16.269 -6.022 -10.231 1.00 74.11 C ATOM 986 NZ LYS A 62 -16.969 -6.341 -11.506 1.00 52.14 N ATOM 0 H LYS A 62 -11.301 -5.788 -9.052 1.00 2.12 H new ATOM 0 HA LYS A 62 -12.609 -6.749 -6.669 1.00 64.01 H new ATOM 0 HB2 LYS A 62 -12.650 -7.658 -9.574 1.00 23.22 H new ATOM 0 HB3 LYS A 62 -13.696 -8.297 -8.321 1.00 23.22 H new ATOM 0 HG2 LYS A 62 -14.917 -6.295 -8.129 1.00 55.21 H new ATOM 0 HG3 LYS A 62 -13.644 -5.328 -8.847 1.00 55.21 H new ATOM 0 HD2 LYS A 62 -14.273 -5.831 -10.998 1.00 11.02 H new ATOM 0 HD3 LYS A 62 -14.731 -7.475 -10.599 1.00 11.02 H new ATOM 0 HE2 LYS A 62 -16.770 -6.527 -9.405 1.00 74.11 H new ATOM 0 HE3 LYS A 62 -16.337 -4.951 -10.038 1.00 74.11 H new ATOM 0 HZ1 LYS A 62 -17.976 -6.516 -11.315 1.00 52.14 H new ATOM 0 HZ2 LYS A 62 -16.875 -5.540 -12.163 1.00 52.14 H new ATOM 0 HZ3 LYS A 62 -16.545 -7.190 -11.932 1.00 52.14 H new ATOM 1000 N GLY A 63 -10.078 -8.345 -7.920 1.00 2.40 N ATOM 1001 CA GLY A 63 -9.180 -9.464 -7.703 1.00 50.14 C ATOM 1002 C GLY A 63 -9.401 -10.586 -8.699 1.00 13.33 C ATOM 1003 O GLY A 63 -9.135 -11.751 -8.402 1.00 75.14 O ATOM 0 H GLY A 63 -9.740 -7.647 -8.583 1.00 2.40 H new ATOM 0 HA2 GLY A 63 -8.149 -9.118 -7.773 1.00 50.14 H new ATOM 0 HA3 GLY A 63 -9.319 -9.847 -6.692 1.00 50.14 H new ATOM 1007 N THR A 64 -9.892 -10.235 -9.884 1.00 24.32 N ATOM 1008 CA THR A 64 -10.152 -11.221 -10.925 1.00 64.11 C ATOM 1009 C THR A 64 -8.969 -12.168 -11.093 1.00 71.32 C ATOM 1010 O THR A 64 -9.147 -13.373 -11.274 1.00 70.04 O ATOM 1011 CB THR A 64 -10.450 -10.545 -12.277 1.00 24.32 C ATOM 1012 OG1 THR A 64 -10.656 -11.539 -13.287 1.00 31.34 O ATOM 1013 CG2 THR A 64 -9.307 -9.628 -12.687 1.00 32.32 C ATOM 0 H THR A 64 -10.117 -9.275 -10.146 1.00 24.32 H new ATOM 0 HA THR A 64 -11.027 -11.790 -10.611 1.00 64.11 H new ATOM 0 HB THR A 64 -11.354 -9.946 -12.167 1.00 24.32 H new ATOM 0 HG1 THR A 64 -10.846 -11.101 -14.143 1.00 31.34 H new ATOM 0 HG21 THR A 64 -9.540 -9.162 -13.644 1.00 32.32 H new ATOM 0 HG22 THR A 64 -9.171 -8.855 -11.931 1.00 32.32 H new ATOM 0 HG23 THR A 64 -8.390 -10.209 -12.780 1.00 32.32 H new ATOM 1021 N TYR A 65 -7.762 -11.617 -11.031 1.00 52.25 N ATOM 1022 CA TYR A 65 -6.550 -12.413 -11.179 1.00 24.03 C ATOM 1023 C TYR A 65 -6.532 -13.568 -10.182 1.00 41.00 C ATOM 1024 O TYR A 65 -6.673 -13.364 -8.977 1.00 30.54 O ATOM 1025 CB TYR A 65 -5.312 -11.536 -10.982 1.00 63.24 C ATOM 1026 CG TYR A 65 -5.410 -10.607 -9.794 1.00 13.12 C ATOM 1027 CD1 TYR A 65 -5.104 -11.050 -8.513 1.00 44.31 C ATOM 1028 CD2 TYR A 65 -5.809 -9.285 -9.952 1.00 32.21 C ATOM 1029 CE1 TYR A 65 -5.193 -10.204 -7.424 1.00 71.14 C ATOM 1030 CE2 TYR A 65 -5.900 -8.432 -8.869 1.00 71.11 C ATOM 1031 CZ TYR A 65 -5.591 -8.896 -7.607 1.00 75.44 C ATOM 1032 OH TYR A 65 -5.680 -8.051 -6.526 1.00 15.53 O ATOM 0 H TYR A 65 -7.597 -10.622 -10.879 1.00 52.25 H new ATOM 0 HA TYR A 65 -6.538 -12.827 -12.187 1.00 24.03 H new ATOM 0 HB2 TYR A 65 -4.439 -12.177 -10.860 1.00 63.24 H new ATOM 0 HB3 TYR A 65 -5.150 -10.944 -11.883 1.00 63.24 H new ATOM 0 HD1 TYR A 65 -4.791 -12.073 -8.366 1.00 44.31 H new ATOM 0 HD2 TYR A 65 -6.052 -8.918 -10.938 1.00 32.21 H new ATOM 0 HE1 TYR A 65 -4.952 -10.565 -6.435 1.00 71.14 H new ATOM 0 HE2 TYR A 65 -6.211 -7.407 -9.010 1.00 71.11 H new ATOM 0 HH TYR A 65 -5.973 -7.165 -6.826 1.00 15.53 H new ATOM 1042 N ALA A 66 -6.357 -14.781 -10.695 1.00 62.24 N ATOM 1043 CA ALA A 66 -6.318 -15.969 -9.852 1.00 25.31 C ATOM 1044 C ALA A 66 -4.901 -16.525 -9.752 1.00 71.33 C ATOM 1045 O ALA A 66 -4.527 -17.124 -8.743 1.00 70.54 O ATOM 1046 CB ALA A 66 -7.266 -17.030 -10.390 1.00 34.12 C ATOM 0 H ALA A 66 -6.240 -14.967 -11.691 1.00 62.24 H new ATOM 0 HA ALA A 66 -6.640 -15.684 -8.851 1.00 25.31 H new ATOM 0 HB1 ALA A 66 -7.226 -17.912 -9.750 1.00 34.12 H new ATOM 0 HB2 ALA A 66 -8.283 -16.637 -10.403 1.00 34.12 H new ATOM 0 HB3 ALA A 66 -6.970 -17.303 -11.403 1.00 34.12 H new ATOM 1052 N THR A 67 -4.116 -16.324 -10.806 1.00 23.00 N ATOM 1053 CA THR A 67 -2.741 -16.807 -10.838 1.00 0.11 C ATOM 1054 C THR A 67 -2.016 -16.319 -12.087 1.00 21.30 C ATOM 1055 O THR A 67 -2.573 -15.566 -12.886 1.00 32.32 O ATOM 1056 CB THR A 67 -2.685 -18.346 -10.793 1.00 42.52 C ATOM 1057 OG1 THR A 67 -4.003 -18.888 -10.927 1.00 32.02 O ATOM 1058 CG2 THR A 67 -2.063 -18.827 -9.491 1.00 44.31 C ATOM 0 H THR A 67 -4.409 -15.830 -11.649 1.00 23.00 H new ATOM 0 HA THR A 67 -2.245 -16.407 -9.954 1.00 0.11 H new ATOM 0 HB THR A 67 -2.066 -18.690 -11.621 1.00 42.52 H new ATOM 0 HG1 THR A 67 -3.959 -19.867 -10.899 1.00 32.02 H new ATOM 0 HG21 THR A 67 -2.034 -19.917 -9.482 1.00 44.31 H new ATOM 0 HG22 THR A 67 -1.049 -18.437 -9.406 1.00 44.31 H new ATOM 0 HG23 THR A 67 -2.660 -18.473 -8.650 1.00 44.31 H new ATOM 1066 N ASP A 68 -0.771 -16.754 -12.250 1.00 11.50 N ATOM 1067 CA ASP A 68 0.030 -16.362 -13.404 1.00 22.30 C ATOM 1068 C ASP A 68 -0.640 -16.797 -14.704 1.00 31.15 C ATOM 1069 O ASP A 68 -0.478 -16.157 -15.742 1.00 53.53 O ATOM 1070 CB ASP A 68 1.430 -16.971 -13.309 1.00 43.34 C ATOM 1071 CG ASP A 68 2.042 -16.804 -11.932 1.00 62.03 C ATOM 1072 OD1 ASP A 68 2.013 -15.673 -11.403 1.00 74.43 O ATOM 1073 OD2 ASP A 68 2.551 -17.804 -11.384 1.00 24.11 O ATOM 0 H ASP A 68 -0.295 -17.378 -11.598 1.00 11.50 H new ATOM 0 HA ASP A 68 0.113 -15.275 -13.406 1.00 22.30 H new ATOM 0 HB2 ASP A 68 1.379 -18.032 -13.554 1.00 43.34 H new ATOM 0 HB3 ASP A 68 2.078 -16.503 -14.050 1.00 43.34 H new ATOM 1078 N VAL A 69 -1.393 -17.891 -14.638 1.00 43.12 N ATOM 1079 CA VAL A 69 -2.088 -18.412 -15.809 1.00 43.33 C ATOM 1080 C VAL A 69 -3.227 -17.489 -16.227 1.00 73.44 C ATOM 1081 O VAL A 69 -3.344 -17.121 -17.396 1.00 54.03 O ATOM 1082 CB VAL A 69 -2.652 -19.821 -15.547 1.00 11.55 C ATOM 1083 CG1 VAL A 69 -3.462 -20.303 -16.740 1.00 41.34 C ATOM 1084 CG2 VAL A 69 -1.527 -20.794 -15.227 1.00 14.53 C ATOM 0 H VAL A 69 -1.537 -18.433 -13.786 1.00 43.12 H new ATOM 0 HA VAL A 69 -1.355 -18.467 -16.614 1.00 43.33 H new ATOM 0 HB VAL A 69 -3.316 -19.773 -14.684 1.00 11.55 H new ATOM 0 HG11 VAL A 69 -3.852 -21.300 -16.536 1.00 41.34 H new ATOM 0 HG12 VAL A 69 -4.291 -19.618 -16.917 1.00 41.34 H new ATOM 0 HG13 VAL A 69 -2.824 -20.337 -17.623 1.00 41.34 H new ATOM 0 HG21 VAL A 69 -1.944 -21.785 -15.045 1.00 14.53 H new ATOM 0 HG22 VAL A 69 -0.836 -20.840 -16.068 1.00 14.53 H new ATOM 0 HG23 VAL A 69 -0.995 -20.455 -14.338 1.00 14.53 H new ATOM 1094 N ASP A 70 -4.065 -17.119 -15.265 1.00 22.41 N ATOM 1095 CA ASP A 70 -5.195 -16.238 -15.532 1.00 54.03 C ATOM 1096 C ASP A 70 -4.718 -14.880 -16.039 1.00 32.43 C ATOM 1097 O ASP A 70 -5.302 -14.309 -16.960 1.00 31.41 O ATOM 1098 CB ASP A 70 -6.039 -16.057 -14.269 1.00 64.41 C ATOM 1099 CG ASP A 70 -7.526 -16.149 -14.548 1.00 10.11 C ATOM 1100 OD1 ASP A 70 -7.957 -17.157 -15.146 1.00 70.11 O ATOM 1101 OD2 ASP A 70 -8.259 -15.213 -14.167 1.00 52.32 O ATOM 0 H ASP A 70 -3.983 -17.416 -14.293 1.00 22.41 H new ATOM 0 HA ASP A 70 -5.808 -16.700 -16.306 1.00 54.03 H new ATOM 0 HB2 ASP A 70 -5.762 -16.817 -13.538 1.00 64.41 H new ATOM 0 HB3 ASP A 70 -5.815 -15.088 -13.822 1.00 64.41 H new ATOM 1106 N VAL A 71 -3.653 -14.368 -15.430 1.00 35.14 N ATOM 1107 CA VAL A 71 -3.098 -13.078 -15.818 1.00 45.44 C ATOM 1108 C VAL A 71 -2.514 -13.132 -17.226 1.00 22.13 C ATOM 1109 O VAL A 71 -2.723 -12.225 -18.030 1.00 53.40 O ATOM 1110 CB VAL A 71 -2.002 -12.620 -14.837 1.00 42.04 C ATOM 1111 CG1 VAL A 71 -1.324 -11.357 -15.345 1.00 42.43 C ATOM 1112 CG2 VAL A 71 -2.587 -12.400 -13.451 1.00 21.25 C ATOM 0 H VAL A 71 -3.158 -14.828 -14.666 1.00 35.14 H new ATOM 0 HA VAL A 71 -3.919 -12.361 -15.795 1.00 45.44 H new ATOM 0 HB VAL A 71 -1.249 -13.405 -14.768 1.00 42.04 H new ATOM 0 HG11 VAL A 71 -0.553 -11.049 -14.639 1.00 42.43 H new ATOM 0 HG12 VAL A 71 -0.869 -11.554 -16.316 1.00 42.43 H new ATOM 0 HG13 VAL A 71 -2.063 -10.562 -15.445 1.00 42.43 H new ATOM 0 HG21 VAL A 71 -1.799 -12.077 -12.771 1.00 21.25 H new ATOM 0 HG22 VAL A 71 -3.361 -11.634 -13.500 1.00 21.25 H new ATOM 0 HG23 VAL A 71 -3.021 -13.331 -13.087 1.00 21.25 H new ATOM 1122 N GLN A 72 -1.781 -14.203 -17.516 1.00 14.35 N ATOM 1123 CA GLN A 72 -1.167 -14.375 -18.827 1.00 31.24 C ATOM 1124 C GLN A 72 -2.229 -14.468 -19.917 1.00 40.24 C ATOM 1125 O GLN A 72 -2.061 -13.925 -21.008 1.00 42.43 O ATOM 1126 CB GLN A 72 -0.292 -15.630 -18.842 1.00 53.12 C ATOM 1127 CG GLN A 72 0.210 -16.004 -20.227 1.00 60.32 C ATOM 1128 CD GLN A 72 -0.739 -16.931 -20.961 1.00 42.04 C ATOM 1129 OE1 GLN A 72 -1.176 -17.947 -20.420 1.00 64.10 O ATOM 1130 NE2 GLN A 72 -1.064 -16.585 -22.202 1.00 4.24 N ATOM 0 H GLN A 72 -1.598 -14.963 -16.861 1.00 14.35 H new ATOM 0 HA GLN A 72 -0.544 -13.503 -19.026 1.00 31.24 H new ATOM 0 HB2 GLN A 72 0.563 -15.475 -18.184 1.00 53.12 H new ATOM 0 HB3 GLN A 72 -0.861 -16.465 -18.433 1.00 53.12 H new ATOM 0 HG2 GLN A 72 0.353 -15.097 -20.815 1.00 60.32 H new ATOM 0 HG3 GLN A 72 1.185 -16.484 -20.139 1.00 60.32 H new ATOM 0 HE21 GLN A 72 -0.679 -15.734 -22.612 1.00 4.24 H new ATOM 0 HE22 GLN A 72 -1.699 -17.170 -22.745 1.00 4.24 H new ATOM 1139 N ASN A 73 -3.322 -15.160 -19.615 1.00 15.04 N ATOM 1140 CA ASN A 73 -4.412 -15.325 -20.570 1.00 41.52 C ATOM 1141 C ASN A 73 -5.134 -14.001 -20.805 1.00 31.30 C ATOM 1142 O ASN A 73 -5.496 -13.672 -21.935 1.00 4.53 O ATOM 1143 CB ASN A 73 -5.403 -16.377 -20.069 1.00 63.44 C ATOM 1144 CG ASN A 73 -5.444 -17.603 -20.961 1.00 62.23 C ATOM 1145 OD1 ASN A 73 -5.344 -17.499 -22.184 1.00 1.41 O ATOM 1146 ND2 ASN A 73 -5.592 -18.774 -20.352 1.00 2.54 N ATOM 0 H ASN A 73 -3.477 -15.616 -18.716 1.00 15.04 H new ATOM 0 HA ASN A 73 -3.985 -15.659 -21.516 1.00 41.52 H new ATOM 0 HB2 ASN A 73 -5.130 -16.676 -19.057 1.00 63.44 H new ATOM 0 HB3 ASN A 73 -6.399 -15.937 -20.014 1.00 63.44 H new ATOM 0 HD21 ASN A 73 -5.627 -19.633 -20.900 1.00 2.54 H new ATOM 0 HD22 ASN A 73 -5.671 -18.814 -19.336 1.00 2.54 H new ATOM 1153 N ASP A 74 -5.340 -13.248 -19.731 1.00 11.53 N ATOM 1154 CA ASP A 74 -6.017 -11.959 -19.819 1.00 75.12 C ATOM 1155 C ASP A 74 -5.224 -10.986 -20.686 1.00 23.25 C ATOM 1156 O ASP A 74 -5.766 -10.372 -21.604 1.00 51.03 O ATOM 1157 CB ASP A 74 -6.221 -11.369 -18.423 1.00 1.11 C ATOM 1158 CG ASP A 74 -7.176 -10.191 -18.426 1.00 21.54 C ATOM 1159 OD1 ASP A 74 -8.403 -10.423 -18.449 1.00 64.21 O ATOM 1160 OD2 ASP A 74 -6.697 -9.038 -18.405 1.00 64.20 O ATOM 0 H ASP A 74 -5.048 -13.507 -18.789 1.00 11.53 H new ATOM 0 HA ASP A 74 -6.990 -12.119 -20.282 1.00 75.12 H new ATOM 0 HB2 ASP A 74 -6.605 -12.142 -17.757 1.00 1.11 H new ATOM 0 HB3 ASP A 74 -5.259 -11.052 -18.022 1.00 1.11 H new ATOM 1165 N VAL A 75 -3.936 -10.850 -20.386 1.00 22.02 N ATOM 1166 CA VAL A 75 -3.067 -9.952 -21.137 1.00 1.11 C ATOM 1167 C VAL A 75 -2.937 -10.399 -22.589 1.00 35.04 C ATOM 1168 O VAL A 75 -2.911 -9.575 -23.502 1.00 60.34 O ATOM 1169 CB VAL A 75 -1.663 -9.873 -20.508 1.00 60.33 C ATOM 1170 CG1 VAL A 75 -1.736 -9.277 -19.111 1.00 31.33 C ATOM 1171 CG2 VAL A 75 -1.016 -11.250 -20.477 1.00 11.23 C ATOM 0 H VAL A 75 -3.472 -11.350 -19.628 1.00 22.02 H new ATOM 0 HA VAL A 75 -3.528 -8.965 -21.104 1.00 1.11 H new ATOM 0 HB VAL A 75 -1.044 -9.219 -21.123 1.00 60.33 H new ATOM 0 HG11 VAL A 75 -0.735 -9.229 -18.683 1.00 31.33 H new ATOM 0 HG12 VAL A 75 -2.156 -8.272 -19.165 1.00 31.33 H new ATOM 0 HG13 VAL A 75 -2.370 -9.901 -18.482 1.00 31.33 H new ATOM 0 HG21 VAL A 75 -0.025 -11.176 -20.030 1.00 11.23 H new ATOM 0 HG22 VAL A 75 -1.631 -11.928 -19.886 1.00 11.23 H new ATOM 0 HG23 VAL A 75 -0.928 -11.633 -21.493 1.00 11.23 H new ATOM 1181 N ALA A 76 -2.858 -11.710 -22.793 1.00 43.34 N ATOM 1182 CA ALA A 76 -2.734 -12.267 -24.134 1.00 63.25 C ATOM 1183 C ALA A 76 -3.934 -11.894 -24.997 1.00 52.24 C ATOM 1184 O ALA A 76 -3.779 -11.453 -26.136 1.00 62.24 O ATOM 1185 CB ALA A 76 -2.581 -13.779 -24.065 1.00 62.44 C ATOM 0 H ALA A 76 -2.878 -12.405 -22.047 1.00 43.34 H new ATOM 0 HA ALA A 76 -1.842 -11.843 -24.596 1.00 63.25 H new ATOM 0 HB1 ALA A 76 -2.489 -14.182 -25.074 1.00 62.44 H new ATOM 0 HB2 ALA A 76 -1.688 -14.029 -23.492 1.00 62.44 H new ATOM 0 HB3 ALA A 76 -3.456 -14.211 -23.580 1.00 62.44 H new ATOM 1191 N ARG A 77 -5.131 -12.074 -24.448 1.00 2.52 N ATOM 1192 CA ARG A 77 -6.358 -11.757 -25.169 1.00 21.13 C ATOM 1193 C ARG A 77 -6.451 -10.261 -25.453 1.00 50.21 C ATOM 1194 O ARG A 77 -6.848 -9.850 -26.543 1.00 43.11 O ATOM 1195 CB ARG A 77 -7.578 -12.211 -24.365 1.00 71.34 C ATOM 1196 CG ARG A 77 -8.748 -12.650 -25.231 1.00 30.22 C ATOM 1197 CD ARG A 77 -9.913 -13.141 -24.385 1.00 51.54 C ATOM 1198 NE ARG A 77 -10.364 -14.468 -24.793 1.00 34.31 N ATOM 1199 CZ ARG A 77 -11.190 -15.218 -24.071 1.00 10.42 C ATOM 1200 NH1 ARG A 77 -11.652 -14.772 -22.911 1.00 54.41 N ATOM 1201 NH2 ARG A 77 -11.555 -16.416 -24.509 1.00 11.21 N ATOM 0 H ARG A 77 -5.277 -12.438 -23.506 1.00 2.52 H new ATOM 0 HA ARG A 77 -6.339 -12.289 -26.120 1.00 21.13 H new ATOM 0 HB2 ARG A 77 -7.288 -13.037 -23.715 1.00 71.34 H new ATOM 0 HB3 ARG A 77 -7.901 -11.395 -23.719 1.00 71.34 H new ATOM 0 HG2 ARG A 77 -9.074 -11.817 -25.853 1.00 30.22 H new ATOM 0 HG3 ARG A 77 -8.426 -13.444 -25.905 1.00 30.22 H new ATOM 0 HD2 ARG A 77 -9.615 -13.166 -23.337 1.00 51.54 H new ATOM 0 HD3 ARG A 77 -10.741 -12.436 -24.464 1.00 51.54 H new ATOM 0 HE ARG A 77 -10.027 -14.840 -25.681 1.00 34.31 H new ATOM 0 HH11 ARG A 77 -11.374 -13.851 -22.571 1.00 54.41 H new ATOM 0 HH12 ARG A 77 -12.286 -15.349 -22.359 1.00 54.41 H new ATOM 0 HH21 ARG A 77 -11.202 -16.762 -25.401 1.00 11.21 H new ATOM 0 HH22 ARG A 77 -12.189 -16.991 -23.954 1.00 11.21 H new ATOM 1215 N MET A 78 -6.083 -9.452 -24.465 1.00 12.02 N ATOM 1216 CA MET A 78 -6.125 -8.001 -24.609 1.00 63.45 C ATOM 1217 C MET A 78 -5.204 -7.541 -25.735 1.00 1.30 C ATOM 1218 O MET A 78 -5.554 -6.651 -26.511 1.00 34.20 O ATOM 1219 CB MET A 78 -5.723 -7.325 -23.297 1.00 54.13 C ATOM 1220 CG MET A 78 -6.642 -7.662 -22.134 1.00 52.21 C ATOM 1221 SD MET A 78 -7.503 -6.215 -21.487 1.00 65.31 S ATOM 1222 CE MET A 78 -8.181 -6.877 -19.967 1.00 54.14 C ATOM 0 H MET A 78 -5.752 -9.776 -23.556 1.00 12.02 H new ATOM 0 HA MET A 78 -7.147 -7.714 -24.858 1.00 63.45 H new ATOM 0 HB2 MET A 78 -4.705 -7.620 -23.043 1.00 54.13 H new ATOM 0 HB3 MET A 78 -5.715 -6.245 -23.442 1.00 54.13 H new ATOM 0 HG2 MET A 78 -7.375 -8.401 -22.457 1.00 52.21 H new ATOM 0 HG3 MET A 78 -6.058 -8.120 -21.335 1.00 52.21 H new ATOM 0 HE1 MET A 78 -9.147 -6.413 -19.767 1.00 54.14 H new ATOM 0 HE2 MET A 78 -8.310 -7.955 -20.065 1.00 54.14 H new ATOM 0 HE3 MET A 78 -7.500 -6.667 -19.143 1.00 54.14 H new ATOM 1232 N ILE A 79 -4.027 -8.151 -25.817 1.00 45.13 N ATOM 1233 CA ILE A 79 -3.057 -7.803 -26.848 1.00 62.15 C ATOM 1234 C ILE A 79 -3.561 -8.196 -28.233 1.00 35.43 C ATOM 1235 O ILE A 79 -3.466 -7.421 -29.185 1.00 12.24 O ATOM 1236 CB ILE A 79 -1.699 -8.484 -26.597 1.00 23.31 C ATOM 1237 CG1 ILE A 79 -1.127 -8.048 -25.246 1.00 41.25 C ATOM 1238 CG2 ILE A 79 -0.726 -8.158 -27.720 1.00 52.24 C ATOM 1239 CD1 ILE A 79 -0.280 -9.108 -24.578 1.00 12.03 C ATOM 0 H ILE A 79 -3.722 -8.889 -25.182 1.00 45.13 H new ATOM 0 HA ILE A 79 -2.926 -6.722 -26.805 1.00 62.15 H new ATOM 0 HB ILE A 79 -1.850 -9.563 -26.576 1.00 23.31 H new ATOM 0 HG12 ILE A 79 -0.526 -7.150 -25.388 1.00 41.25 H new ATOM 0 HG13 ILE A 79 -1.949 -7.780 -24.582 1.00 41.25 H new ATOM 0 HG21 ILE A 79 0.229 -8.647 -27.527 1.00 52.24 H new ATOM 0 HG22 ILE A 79 -1.131 -8.514 -28.667 1.00 52.24 H new ATOM 0 HG23 ILE A 79 -0.578 -7.079 -27.771 1.00 52.24 H new ATOM 0 HD11 ILE A 79 0.092 -8.730 -23.626 1.00 12.03 H new ATOM 0 HD12 ILE A 79 -0.883 -9.999 -24.404 1.00 12.03 H new ATOM 0 HD13 ILE A 79 0.562 -9.360 -25.222 1.00 12.03 H new ATOM 1251 N THR A 80 -4.101 -9.407 -28.338 1.00 51.22 N ATOM 1252 CA THR A 80 -4.622 -9.904 -29.605 1.00 41.34 C ATOM 1253 C THR A 80 -5.726 -8.998 -30.139 1.00 35.54 C ATOM 1254 O THR A 80 -5.736 -8.643 -31.316 1.00 44.42 O ATOM 1255 CB THR A 80 -5.171 -11.336 -29.464 1.00 50.12 C ATOM 1256 OG1 THR A 80 -6.320 -11.338 -28.609 1.00 61.15 O ATOM 1257 CG2 THR A 80 -4.110 -12.269 -28.899 1.00 55.23 C ATOM 0 H THR A 80 -4.189 -10.061 -27.560 1.00 51.22 H new ATOM 0 HA THR A 80 -3.789 -9.910 -30.308 1.00 41.34 H new ATOM 0 HB THR A 80 -5.455 -11.692 -30.454 1.00 50.12 H new ATOM 0 HG1 THR A 80 -6.136 -10.797 -27.813 1.00 61.15 H new ATOM 0 HG21 THR A 80 -4.521 -13.275 -28.808 1.00 55.23 H new ATOM 0 HG22 THR A 80 -3.249 -12.288 -29.567 1.00 55.23 H new ATOM 0 HG23 THR A 80 -3.799 -11.914 -27.916 1.00 55.23 H new ATOM 1265 N ASN A 81 -6.656 -8.629 -29.264 1.00 12.32 N ATOM 1266 CA ASN A 81 -7.766 -7.764 -29.648 1.00 10.04 C ATOM 1267 C ASN A 81 -7.265 -6.376 -30.035 1.00 13.21 C ATOM 1268 O ASN A 81 -7.673 -5.820 -31.055 1.00 25.24 O ATOM 1269 CB ASN A 81 -8.774 -7.654 -28.502 1.00 3.55 C ATOM 1270 CG ASN A 81 -9.569 -8.930 -28.306 1.00 3.04 C ATOM 1271 OD1 ASN A 81 -10.116 -9.486 -29.258 1.00 13.31 O ATOM 1272 ND2 ASN A 81 -9.635 -9.401 -27.066 1.00 15.23 N ATOM 0 H ASN A 81 -6.663 -8.915 -28.285 1.00 12.32 H new ATOM 0 HA ASN A 81 -8.258 -8.208 -30.514 1.00 10.04 H new ATOM 0 HB2 ASN A 81 -8.246 -7.413 -27.579 1.00 3.55 H new ATOM 0 HB3 ASN A 81 -9.459 -6.830 -28.702 1.00 3.55 H new ATOM 0 HD21 ASN A 81 -10.155 -10.257 -26.873 1.00 15.23 H new ATOM 0 HD22 ASN A 81 -9.166 -8.907 -26.307 1.00 15.23 H new ATOM 1279 N ALA A 82 -6.379 -5.822 -29.214 1.00 31.03 N ATOM 1280 CA ALA A 82 -5.821 -4.501 -29.471 1.00 44.43 C ATOM 1281 C ALA A 82 -5.177 -4.436 -30.852 1.00 74.24 C ATOM 1282 O ALA A 82 -5.611 -3.672 -31.716 1.00 34.22 O ATOM 1283 CB ALA A 82 -4.806 -4.138 -28.397 1.00 51.20 C ATOM 0 H ALA A 82 -6.032 -6.268 -28.365 1.00 31.03 H new ATOM 0 HA ALA A 82 -6.637 -3.778 -29.444 1.00 44.43 H new ATOM 0 HB1 ALA A 82 -4.397 -3.148 -28.602 1.00 51.20 H new ATOM 0 HB2 ALA A 82 -5.293 -4.134 -27.422 1.00 51.20 H new ATOM 0 HB3 ALA A 82 -3.999 -4.871 -28.396 1.00 51.20 H new ATOM 1289 N LEU A 83 -4.140 -5.241 -31.055 1.00 75.40 N ATOM 1290 CA LEU A 83 -3.436 -5.276 -32.332 1.00 53.52 C ATOM 1291 C LEU A 83 -4.394 -5.604 -33.473 1.00 64.43 C ATOM 1292 O LEU A 83 -4.227 -5.124 -34.594 1.00 3.45 O ATOM 1293 CB LEU A 83 -2.306 -6.305 -32.287 1.00 32.55 C ATOM 1294 CG LEU A 83 -2.718 -7.763 -32.494 1.00 60.43 C ATOM 1295 CD1 LEU A 83 -2.667 -8.127 -33.970 1.00 75.11 C ATOM 1296 CD2 LEU A 83 -1.824 -8.691 -31.684 1.00 13.33 C ATOM 0 H LEU A 83 -3.768 -5.879 -30.351 1.00 75.40 H new ATOM 0 HA LEU A 83 -3.011 -4.288 -32.511 1.00 53.52 H new ATOM 0 HB2 LEU A 83 -1.573 -6.044 -33.050 1.00 32.55 H new ATOM 0 HB3 LEU A 83 -1.805 -6.223 -31.322 1.00 32.55 H new ATOM 0 HG LEU A 83 -3.744 -7.883 -32.145 1.00 60.43 H new ATOM 0 HD11 LEU A 83 -2.963 -9.168 -34.098 1.00 75.11 H new ATOM 0 HD12 LEU A 83 -3.349 -7.484 -34.527 1.00 75.11 H new ATOM 0 HD13 LEU A 83 -1.652 -7.990 -34.344 1.00 75.11 H new ATOM 0 HD21 LEU A 83 -2.132 -9.724 -31.844 1.00 13.33 H new ATOM 0 HD22 LEU A 83 -0.789 -8.568 -32.002 1.00 13.33 H new ATOM 0 HD23 LEU A 83 -1.910 -8.446 -30.625 1.00 13.33 H new ATOM 1308 N GLU A 84 -5.397 -6.425 -33.179 1.00 53.11 N ATOM 1309 CA GLU A 84 -6.382 -6.816 -34.181 1.00 20.11 C ATOM 1310 C GLU A 84 -7.180 -5.607 -34.661 1.00 23.11 C ATOM 1311 O GLU A 84 -7.531 -5.508 -35.837 1.00 23.31 O ATOM 1312 CB GLU A 84 -7.330 -7.873 -33.611 1.00 12.03 C ATOM 1313 CG GLU A 84 -8.601 -8.052 -34.424 1.00 33.33 C ATOM 1314 CD GLU A 84 -9.287 -9.377 -34.150 1.00 1.21 C ATOM 1315 OE1 GLU A 84 -9.624 -9.640 -32.977 1.00 10.33 O ATOM 1316 OE2 GLU A 84 -9.487 -10.150 -35.110 1.00 25.41 O ATOM 0 H GLU A 84 -5.549 -6.832 -32.256 1.00 53.11 H new ATOM 0 HA GLU A 84 -5.848 -7.238 -35.032 1.00 20.11 H new ATOM 0 HB2 GLU A 84 -6.806 -8.827 -33.557 1.00 12.03 H new ATOM 0 HB3 GLU A 84 -7.597 -7.597 -32.591 1.00 12.03 H new ATOM 0 HG2 GLU A 84 -9.289 -7.237 -34.199 1.00 33.33 H new ATOM 0 HG3 GLU A 84 -8.362 -7.984 -35.485 1.00 33.33 H new ATOM 1323 N TYR A 85 -7.463 -4.690 -33.742 1.00 60.33 N ATOM 1324 CA TYR A 85 -8.222 -3.489 -34.070 1.00 22.11 C ATOM 1325 C TYR A 85 -7.300 -2.382 -34.571 1.00 64.03 C ATOM 1326 O TYR A 85 -7.692 -1.558 -35.397 1.00 31.54 O ATOM 1327 CB TYR A 85 -9.001 -3.004 -32.847 1.00 15.33 C ATOM 1328 CG TYR A 85 -9.600 -1.626 -33.018 1.00 5.44 C ATOM 1329 CD1 TYR A 85 -10.305 -1.290 -34.167 1.00 22.23 C ATOM 1330 CD2 TYR A 85 -9.460 -0.659 -32.029 1.00 40.12 C ATOM 1331 CE1 TYR A 85 -10.852 -0.032 -34.327 1.00 72.12 C ATOM 1332 CE2 TYR A 85 -10.005 0.601 -32.181 1.00 12.45 C ATOM 1333 CZ TYR A 85 -10.700 0.910 -33.331 1.00 41.14 C ATOM 1334 OH TYR A 85 -11.245 2.164 -33.487 1.00 1.01 O ATOM 0 H TYR A 85 -7.178 -4.756 -32.765 1.00 60.33 H new ATOM 0 HA TYR A 85 -8.925 -3.739 -34.865 1.00 22.11 H new ATOM 0 HB2 TYR A 85 -9.799 -3.714 -32.630 1.00 15.33 H new ATOM 0 HB3 TYR A 85 -8.337 -2.998 -31.983 1.00 15.33 H new ATOM 0 HD1 TYR A 85 -10.427 -2.025 -34.949 1.00 22.23 H new ATOM 0 HD2 TYR A 85 -8.916 -0.897 -31.127 1.00 40.12 H new ATOM 0 HE1 TYR A 85 -11.396 0.213 -35.227 1.00 72.12 H new ATOM 0 HE2 TYR A 85 -9.887 1.341 -31.403 1.00 12.45 H new ATOM 0 HH TYR A 85 -11.049 2.707 -32.695 1.00 1.01 H new ATOM 1344 N ASN A 86 -6.070 -2.371 -34.066 1.00 14.40 N ATOM 1345 CA ASN A 86 -5.091 -1.366 -34.462 1.00 4.52 C ATOM 1346 C ASN A 86 -4.432 -1.740 -35.786 1.00 51.42 C ATOM 1347 O ASN A 86 -3.638 -0.975 -36.334 1.00 72.40 O ATOM 1348 CB ASN A 86 -4.024 -1.207 -33.376 1.00 33.30 C ATOM 1349 CG ASN A 86 -3.897 0.225 -32.895 1.00 44.44 C ATOM 1350 OD1 ASN A 86 -4.846 0.800 -32.362 1.00 23.34 O ATOM 1351 ND2 ASN A 86 -2.719 0.810 -33.084 1.00 30.44 N ATOM 0 H ASN A 86 -5.728 -3.046 -33.382 1.00 14.40 H new ATOM 0 HA ASN A 86 -5.613 -0.418 -34.591 1.00 4.52 H new ATOM 0 HB2 ASN A 86 -4.271 -1.850 -32.531 1.00 33.30 H new ATOM 0 HB3 ASN A 86 -3.062 -1.544 -33.763 1.00 33.30 H new ATOM 0 HD21 ASN A 86 -2.574 1.774 -32.783 1.00 30.44 H new ATOM 0 HD22 ASN A 86 -1.960 0.295 -33.530 1.00 30.44 H new ATOM 1358 N ALA A 87 -4.768 -2.920 -36.295 1.00 73.41 N ATOM 1359 CA ALA A 87 -4.212 -3.395 -37.556 1.00 52.02 C ATOM 1360 C ALA A 87 -4.724 -2.565 -38.729 1.00 5.24 C ATOM 1361 O ALA A 87 -5.796 -2.832 -39.271 1.00 51.40 O ATOM 1362 CB ALA A 87 -4.548 -4.865 -37.761 1.00 53.33 C ATOM 0 H ALA A 87 -5.423 -3.565 -35.853 1.00 73.41 H new ATOM 0 HA ALA A 87 -3.129 -3.284 -37.511 1.00 52.02 H new ATOM 0 HB1 ALA A 87 -4.127 -5.206 -38.707 1.00 53.33 H new ATOM 0 HB2 ALA A 87 -4.128 -5.452 -36.944 1.00 53.33 H new ATOM 0 HB3 ALA A 87 -5.630 -4.992 -37.780 1.00 53.33 H new ATOM 1368 N LYS A 88 -3.950 -1.556 -39.115 1.00 62.23 N ATOM 1369 CA LYS A 88 -4.323 -0.686 -40.224 1.00 73.22 C ATOM 1370 C LYS A 88 -3.276 0.401 -40.439 1.00 42.51 C ATOM 1371 O LYS A 88 -2.849 1.062 -39.493 1.00 34.23 O ATOM 1372 CB LYS A 88 -5.689 -0.049 -39.961 1.00 55.43 C ATOM 1373 CG LYS A 88 -6.703 -0.305 -41.063 1.00 44.15 C ATOM 1374 CD LYS A 88 -8.109 -0.444 -40.506 1.00 55.34 C ATOM 1375 CE LYS A 88 -8.984 0.737 -40.900 1.00 4.34 C ATOM 1376 NZ LYS A 88 -8.494 2.012 -40.306 1.00 24.02 N ATOM 0 H LYS A 88 -3.060 -1.321 -38.676 1.00 62.23 H new ATOM 0 HA LYS A 88 -4.380 -1.294 -41.127 1.00 73.22 H new ATOM 0 HB2 LYS A 88 -6.084 -0.432 -39.020 1.00 55.43 H new ATOM 0 HB3 LYS A 88 -5.561 1.027 -39.839 1.00 55.43 H new ATOM 0 HG2 LYS A 88 -6.675 0.514 -41.782 1.00 44.15 H new ATOM 0 HG3 LYS A 88 -6.433 -1.213 -41.603 1.00 44.15 H new ATOM 0 HD2 LYS A 88 -8.557 -1.368 -40.872 1.00 55.34 H new ATOM 0 HD3 LYS A 88 -8.065 -0.519 -39.419 1.00 55.34 H new ATOM 0 HE2 LYS A 88 -9.006 0.827 -41.986 1.00 4.34 H new ATOM 0 HE3 LYS A 88 -10.008 0.555 -40.575 1.00 4.34 H new ATOM 0 HZ1 LYS A 88 -9.135 2.787 -40.570 1.00 24.02 H new ATOM 0 HZ2 LYS A 88 -8.465 1.924 -39.270 1.00 24.02 H new ATOM 0 HZ3 LYS A 88 -7.539 2.217 -40.663 1.00 24.02 H new ATOM 1390 N GLY A 89 -2.866 0.583 -41.691 1.00 1.31 N ATOM 1391 CA GLY A 89 -1.873 1.593 -42.007 1.00 2.20 C ATOM 1392 C GLY A 89 -0.567 0.992 -42.487 1.00 24.35 C ATOM 1393 O GLY A 89 0.422 1.702 -42.668 1.00 40.13 O ATOM 0 H GLY A 89 -3.204 0.049 -42.492 1.00 1.31 H new ATOM 0 HA2 GLY A 89 -2.267 2.258 -42.775 1.00 2.20 H new ATOM 0 HA3 GLY A 89 -1.686 2.203 -41.123 1.00 2.20 H new ATOM 1397 N SER A 90 -0.561 -0.322 -42.690 1.00 53.24 N ATOM 1398 CA SER A 90 0.635 -1.020 -43.146 1.00 41.34 C ATOM 1399 C SER A 90 1.691 -1.064 -42.046 1.00 11.21 C ATOM 1400 O SER A 90 1.924 -2.106 -41.434 1.00 22.54 O ATOM 1401 CB SER A 90 1.207 -0.337 -44.390 1.00 53.33 C ATOM 1402 OG SER A 90 1.187 -1.210 -45.506 1.00 25.10 O ATOM 0 H SER A 90 -1.371 -0.924 -42.546 1.00 53.24 H new ATOM 0 HA SER A 90 0.355 -2.043 -43.398 1.00 41.34 H new ATOM 0 HB2 SER A 90 0.629 0.559 -44.615 1.00 53.33 H new ATOM 0 HB3 SER A 90 2.230 -0.015 -44.194 1.00 53.33 H new ATOM 0 HG SER A 90 1.556 -0.749 -46.288 1.00 25.10 H new ATOM 1408 N THR A 91 2.328 0.077 -41.799 1.00 73.14 N ATOM 1409 CA THR A 91 3.360 0.170 -40.774 1.00 54.14 C ATOM 1410 C THR A 91 2.778 -0.065 -39.385 1.00 54.13 C ATOM 1411 O THR A 91 3.388 -0.733 -38.551 1.00 45.02 O ATOM 1412 CB THR A 91 4.056 1.544 -40.801 1.00 73.03 C ATOM 1413 OG1 THR A 91 4.131 2.029 -42.147 1.00 32.15 O ATOM 1414 CG2 THR A 91 5.455 1.453 -40.211 1.00 14.54 C ATOM 0 H THR A 91 2.147 0.950 -42.295 1.00 73.14 H new ATOM 0 HA THR A 91 4.094 -0.605 -40.993 1.00 54.14 H new ATOM 0 HB THR A 91 3.469 2.236 -40.198 1.00 73.03 H new ATOM 0 HG1 THR A 91 4.573 2.904 -42.155 1.00 32.15 H new ATOM 0 HG21 THR A 91 5.927 2.435 -40.241 1.00 14.54 H new ATOM 0 HG22 THR A 91 5.393 1.111 -39.178 1.00 14.54 H new ATOM 0 HG23 THR A 91 6.049 0.747 -40.791 1.00 14.54 H new ATOM 1422 N TRP A 92 1.594 0.487 -39.144 1.00 2.31 N ATOM 1423 CA TRP A 92 0.929 0.337 -37.855 1.00 23.45 C ATOM 1424 C TRP A 92 0.772 -1.136 -37.492 1.00 22.01 C ATOM 1425 O TRP A 92 1.099 -1.549 -36.379 1.00 61.31 O ATOM 1426 CB TRP A 92 -0.440 1.017 -37.881 1.00 73.01 C ATOM 1427 CG TRP A 92 -0.617 2.039 -36.799 1.00 41.13 C ATOM 1428 CD1 TRP A 92 -1.660 2.133 -35.923 1.00 21.13 C ATOM 1429 CD2 TRP A 92 0.275 3.113 -36.481 1.00 50.12 C ATOM 1430 NE1 TRP A 92 -1.470 3.201 -35.079 1.00 32.42 N ATOM 1431 CE2 TRP A 92 -0.290 3.818 -35.400 1.00 72.42 C ATOM 1432 CE3 TRP A 92 1.497 3.547 -37.003 1.00 33.13 C ATOM 1433 CZ2 TRP A 92 0.325 4.931 -34.835 1.00 1.23 C ATOM 1434 CZ3 TRP A 92 2.106 4.652 -36.441 1.00 11.55 C ATOM 1435 CH2 TRP A 92 1.520 5.334 -35.365 1.00 64.03 C ATOM 0 H TRP A 92 1.075 1.042 -39.824 1.00 2.31 H new ATOM 0 HA TRP A 92 1.549 0.815 -37.097 1.00 23.45 H new ATOM 0 HB2 TRP A 92 -0.581 1.496 -38.850 1.00 73.01 H new ATOM 0 HB3 TRP A 92 -1.216 0.258 -37.784 1.00 73.01 H new ATOM 0 HD1 TRP A 92 -2.509 1.466 -35.897 1.00 21.13 H new ATOM 0 HE1 TRP A 92 -2.105 3.488 -34.334 1.00 32.42 H new ATOM 0 HE3 TRP A 92 1.957 3.028 -37.831 1.00 33.13 H new ATOM 0 HZ2 TRP A 92 -0.125 5.458 -34.007 1.00 1.23 H new ATOM 0 HZ3 TRP A 92 3.050 4.997 -36.837 1.00 11.55 H new ATOM 0 HH2 TRP A 92 2.022 6.194 -34.947 1.00 64.03 H new ATOM 1446 N TYR A 93 0.271 -1.923 -38.437 1.00 75.20 N ATOM 1447 CA TYR A 93 0.068 -3.350 -38.215 1.00 63.05 C ATOM 1448 C TYR A 93 1.367 -4.024 -37.783 1.00 42.34 C ATOM 1449 O TYR A 93 1.368 -4.890 -36.910 1.00 31.52 O ATOM 1450 CB TYR A 93 -0.466 -4.014 -39.486 1.00 24.12 C ATOM 1451 CG TYR A 93 -0.559 -5.520 -39.388 1.00 71.14 C ATOM 1452 CD1 TYR A 93 -1.211 -6.128 -38.323 1.00 23.15 C ATOM 1453 CD2 TYR A 93 0.004 -6.335 -40.363 1.00 54.01 C ATOM 1454 CE1 TYR A 93 -1.298 -7.504 -38.229 1.00 44.43 C ATOM 1455 CE2 TYR A 93 -0.080 -7.711 -40.279 1.00 22.42 C ATOM 1456 CZ TYR A 93 -0.731 -8.291 -39.210 1.00 1.11 C ATOM 1457 OH TYR A 93 -0.817 -9.661 -39.121 1.00 63.43 O ATOM 0 H TYR A 93 -0.002 -1.597 -39.364 1.00 75.20 H new ATOM 0 HA TYR A 93 -0.664 -3.467 -37.416 1.00 63.05 H new ATOM 0 HB2 TYR A 93 -1.454 -3.611 -39.709 1.00 24.12 H new ATOM 0 HB3 TYR A 93 0.182 -3.752 -40.323 1.00 24.12 H new ATOM 0 HD1 TYR A 93 -1.658 -5.515 -37.555 1.00 23.15 H new ATOM 0 HD2 TYR A 93 0.516 -5.885 -41.201 1.00 54.01 H new ATOM 0 HE1 TYR A 93 -1.807 -7.960 -37.393 1.00 44.43 H new ATOM 0 HE2 TYR A 93 0.362 -8.330 -41.046 1.00 22.42 H new ATOM 0 HH TYR A 93 -0.368 -10.068 -39.891 1.00 63.43 H new ATOM 1467 N GLN A 94 2.471 -3.617 -38.402 1.00 61.41 N ATOM 1468 CA GLN A 94 3.777 -4.181 -38.082 1.00 61.31 C ATOM 1469 C GLN A 94 4.214 -3.780 -36.677 1.00 34.52 C ATOM 1470 O GLN A 94 4.823 -4.571 -35.957 1.00 62.05 O ATOM 1471 CB GLN A 94 4.819 -3.721 -39.103 1.00 71.12 C ATOM 1472 CG GLN A 94 5.472 -4.864 -39.863 1.00 63.11 C ATOM 1473 CD GLN A 94 6.261 -4.389 -41.068 1.00 15.23 C ATOM 1474 OE1 GLN A 94 5.689 -4.066 -42.110 1.00 24.41 O ATOM 1475 NE2 GLN A 94 7.581 -4.343 -40.931 1.00 54.31 N ATOM 0 H GLN A 94 2.487 -2.900 -39.127 1.00 61.41 H new ATOM 0 HA GLN A 94 3.695 -5.267 -38.121 1.00 61.31 H new ATOM 0 HB2 GLN A 94 4.344 -3.046 -39.815 1.00 71.12 H new ATOM 0 HB3 GLN A 94 5.592 -3.149 -38.589 1.00 71.12 H new ATOM 0 HG2 GLN A 94 6.135 -5.410 -39.192 1.00 63.11 H new ATOM 0 HG3 GLN A 94 4.703 -5.564 -40.190 1.00 63.11 H new ATOM 0 HE21 GLN A 94 8.012 -4.620 -40.049 1.00 54.31 H new ATOM 0 HE22 GLN A 94 8.164 -4.031 -41.708 1.00 54.31 H new ATOM 1484 N GLU A 95 3.897 -2.548 -36.293 1.00 44.52 N ATOM 1485 CA GLU A 95 4.259 -2.042 -34.974 1.00 33.41 C ATOM 1486 C GLU A 95 3.548 -2.829 -33.877 1.00 33.24 C ATOM 1487 O GLU A 95 4.163 -3.235 -32.891 1.00 12.51 O ATOM 1488 CB GLU A 95 3.910 -0.557 -34.859 1.00 41.11 C ATOM 1489 CG GLU A 95 4.008 -0.017 -33.442 1.00 54.43 C ATOM 1490 CD GLU A 95 2.732 -0.225 -32.649 1.00 50.24 C ATOM 1491 OE1 GLU A 95 1.647 0.099 -33.176 1.00 41.45 O ATOM 1492 OE2 GLU A 95 2.818 -0.711 -31.503 1.00 22.24 O ATOM 0 H GLU A 95 3.390 -1.882 -36.876 1.00 44.52 H new ATOM 0 HA GLU A 95 5.335 -2.165 -34.848 1.00 33.41 H new ATOM 0 HB2 GLU A 95 4.577 0.015 -35.504 1.00 41.11 H new ATOM 0 HB3 GLU A 95 2.897 -0.401 -35.229 1.00 41.11 H new ATOM 0 HG2 GLU A 95 4.835 -0.506 -32.927 1.00 54.43 H new ATOM 0 HG3 GLU A 95 4.240 1.048 -33.478 1.00 54.43 H new ATOM 1499 N ALA A 96 2.248 -3.040 -34.056 1.00 31.53 N ATOM 1500 CA ALA A 96 1.453 -3.779 -33.083 1.00 31.43 C ATOM 1501 C ALA A 96 1.869 -5.246 -33.034 1.00 55.32 C ATOM 1502 O ALA A 96 1.980 -5.833 -31.959 1.00 25.52 O ATOM 1503 CB ALA A 96 -0.028 -3.659 -33.411 1.00 20.14 C ATOM 0 H ALA A 96 1.723 -2.710 -34.866 1.00 31.53 H new ATOM 0 HA ALA A 96 1.632 -3.345 -32.099 1.00 31.43 H new ATOM 0 HB1 ALA A 96 -0.610 -4.216 -32.676 1.00 20.14 H new ATOM 0 HB2 ALA A 96 -0.322 -2.610 -33.387 1.00 20.14 H new ATOM 0 HB3 ALA A 96 -0.215 -4.066 -34.405 1.00 20.14 H new ATOM 1509 N MET A 97 2.095 -5.831 -34.206 1.00 2.32 N ATOM 1510 CA MET A 97 2.499 -7.229 -34.296 1.00 20.12 C ATOM 1511 C MET A 97 3.905 -7.426 -33.739 1.00 4.21 C ATOM 1512 O MET A 97 4.198 -8.443 -33.110 1.00 74.14 O ATOM 1513 CB MET A 97 2.442 -7.706 -35.748 1.00 72.23 C ATOM 1514 CG MET A 97 2.009 -9.156 -35.895 1.00 65.11 C ATOM 1515 SD MET A 97 3.404 -10.277 -36.119 1.00 33.42 S ATOM 1516 CE MET A 97 2.573 -11.724 -36.771 1.00 64.13 C ATOM 0 H MET A 97 2.005 -5.359 -35.106 1.00 2.32 H new ATOM 0 HA MET A 97 1.805 -7.821 -33.699 1.00 20.12 H new ATOM 0 HB2 MET A 97 1.752 -7.071 -36.304 1.00 72.23 H new ATOM 0 HB3 MET A 97 3.425 -7.581 -36.202 1.00 72.23 H new ATOM 0 HG2 MET A 97 1.446 -9.455 -35.011 1.00 65.11 H new ATOM 0 HG3 MET A 97 1.335 -9.246 -36.747 1.00 65.11 H new ATOM 0 HE1 MET A 97 3.305 -12.509 -36.962 1.00 64.13 H new ATOM 0 HE2 MET A 97 1.840 -12.080 -36.047 1.00 64.13 H new ATOM 0 HE3 MET A 97 2.068 -11.465 -37.702 1.00 64.13 H new ATOM 1526 N SER A 98 4.773 -6.446 -33.974 1.00 34.20 N ATOM 1527 CA SER A 98 6.150 -6.514 -33.499 1.00 73.11 C ATOM 1528 C SER A 98 6.206 -6.405 -31.978 1.00 51.14 C ATOM 1529 O SER A 98 6.947 -7.134 -31.319 1.00 32.30 O ATOM 1530 CB SER A 98 6.985 -5.400 -34.133 1.00 25.50 C ATOM 1531 OG SER A 98 8.245 -5.282 -33.495 1.00 23.30 O ATOM 0 H SER A 98 4.547 -5.596 -34.490 1.00 34.20 H new ATOM 0 HA SER A 98 6.563 -7.479 -33.792 1.00 73.11 H new ATOM 0 HB2 SER A 98 7.129 -5.607 -35.193 1.00 25.50 H new ATOM 0 HB3 SER A 98 6.448 -4.454 -34.063 1.00 25.50 H new ATOM 0 HG SER A 98 8.761 -4.565 -33.919 1.00 23.30 H new ATOM 1537 N PHE A 99 5.417 -5.488 -31.428 1.00 20.12 N ATOM 1538 CA PHE A 99 5.377 -5.281 -29.985 1.00 34.22 C ATOM 1539 C PHE A 99 4.740 -6.477 -29.282 1.00 5.33 C ATOM 1540 O PHE A 99 5.187 -6.891 -28.212 1.00 10.33 O ATOM 1541 CB PHE A 99 4.598 -4.006 -29.653 1.00 24.44 C ATOM 1542 CG PHE A 99 5.455 -2.913 -29.080 1.00 32.42 C ATOM 1543 CD1 PHE A 99 5.697 -2.847 -27.717 1.00 73.11 C ATOM 1544 CD2 PHE A 99 6.018 -1.953 -29.904 1.00 42.21 C ATOM 1545 CE1 PHE A 99 6.484 -1.842 -27.188 1.00 13.14 C ATOM 1546 CE2 PHE A 99 6.806 -0.945 -29.380 1.00 65.42 C ATOM 1547 CZ PHE A 99 7.040 -0.891 -28.020 1.00 42.32 C ATOM 0 H PHE A 99 4.797 -4.877 -31.959 1.00 20.12 H new ATOM 0 HA PHE A 99 6.402 -5.176 -29.629 1.00 34.22 H new ATOM 0 HB2 PHE A 99 4.113 -3.640 -30.558 1.00 24.44 H new ATOM 0 HB3 PHE A 99 3.807 -4.247 -28.943 1.00 24.44 H new ATOM 0 HD1 PHE A 99 5.266 -3.589 -27.061 1.00 73.11 H new ATOM 0 HD2 PHE A 99 5.839 -1.992 -30.968 1.00 42.21 H new ATOM 0 HE1 PHE A 99 6.664 -1.800 -26.124 1.00 13.14 H new ATOM 0 HE2 PHE A 99 7.238 -0.201 -30.033 1.00 65.42 H new ATOM 0 HZ PHE A 99 7.657 -0.106 -27.608 1.00 42.32 H new ATOM 1557 N ARG A 100 3.695 -7.026 -29.891 1.00 31.22 N ATOM 1558 CA ARG A 100 2.996 -8.173 -29.323 1.00 54.41 C ATOM 1559 C ARG A 100 3.959 -9.330 -29.076 1.00 43.34 C ATOM 1560 O ARG A 100 3.717 -10.183 -28.223 1.00 34.21 O ATOM 1561 CB ARG A 100 1.869 -8.623 -30.255 1.00 44.24 C ATOM 1562 CG ARG A 100 1.167 -9.890 -29.795 1.00 0.43 C ATOM 1563 CD ARG A 100 1.586 -11.092 -30.625 1.00 62.52 C ATOM 1564 NE ARG A 100 0.852 -12.298 -30.251 1.00 64.51 N ATOM 1565 CZ ARG A 100 1.114 -13.502 -30.749 1.00 21.05 C ATOM 1566 NH1 ARG A 100 2.087 -13.659 -31.635 1.00 61.23 N ATOM 1567 NH2 ARG A 100 0.402 -14.552 -30.359 1.00 1.44 N ATOM 0 H ARG A 100 3.313 -6.696 -30.777 1.00 31.22 H new ATOM 0 HA ARG A 100 2.569 -7.869 -28.367 1.00 54.41 H new ATOM 0 HB2 ARG A 100 1.135 -7.821 -30.338 1.00 44.24 H new ATOM 0 HB3 ARG A 100 2.277 -8.786 -31.253 1.00 44.24 H new ATOM 0 HG2 ARG A 100 1.396 -10.074 -28.745 1.00 0.43 H new ATOM 0 HG3 ARG A 100 0.088 -9.756 -29.867 1.00 0.43 H new ATOM 0 HD2 ARG A 100 1.420 -10.879 -31.681 1.00 62.52 H new ATOM 0 HD3 ARG A 100 2.655 -11.265 -30.499 1.00 62.52 H new ATOM 0 HE ARG A 100 0.097 -12.211 -29.570 1.00 64.51 H new ATOM 0 HH11 ARG A 100 2.637 -12.855 -31.936 1.00 61.23 H new ATOM 0 HH12 ARG A 100 2.286 -14.584 -32.016 1.00 61.23 H new ATOM 0 HH21 ARG A 100 -0.347 -14.435 -29.677 1.00 1.44 H new ATOM 0 HH22 ARG A 100 0.604 -15.476 -30.742 1.00 1.44 H new ATOM 1581 N LYS A 101 5.054 -9.352 -29.830 1.00 35.32 N ATOM 1582 CA LYS A 101 6.055 -10.403 -29.694 1.00 21.23 C ATOM 1583 C LYS A 101 6.785 -10.290 -28.359 1.00 14.01 C ATOM 1584 O LYS A 101 7.331 -11.271 -27.852 1.00 52.34 O ATOM 1585 CB LYS A 101 7.061 -10.329 -30.845 1.00 21.44 C ATOM 1586 CG LYS A 101 7.312 -11.667 -31.520 1.00 0.32 C ATOM 1587 CD LYS A 101 7.236 -11.550 -33.033 1.00 25.31 C ATOM 1588 CE LYS A 101 8.377 -10.709 -33.585 1.00 10.11 C ATOM 1589 NZ LYS A 101 8.265 -10.521 -35.058 1.00 1.11 N ATOM 0 H LYS A 101 5.270 -8.654 -30.541 1.00 35.32 H new ATOM 0 HA LYS A 101 5.543 -11.365 -29.728 1.00 21.23 H new ATOM 0 HB2 LYS A 101 6.699 -9.619 -31.588 1.00 21.44 H new ATOM 0 HB3 LYS A 101 8.006 -9.940 -30.466 1.00 21.44 H new ATOM 0 HG2 LYS A 101 8.294 -12.043 -31.232 1.00 0.32 H new ATOM 0 HG3 LYS A 101 6.578 -12.394 -31.173 1.00 0.32 H new ATOM 0 HD2 LYS A 101 7.267 -12.545 -33.478 1.00 25.31 H new ATOM 0 HD3 LYS A 101 6.283 -11.104 -33.317 1.00 25.31 H new ATOM 0 HE2 LYS A 101 8.381 -9.736 -33.094 1.00 10.11 H new ATOM 0 HE3 LYS A 101 9.328 -11.188 -33.351 1.00 10.11 H new ATOM 0 HZ1 LYS A 101 9.061 -9.943 -35.396 1.00 1.11 H new ATOM 0 HZ2 LYS A 101 8.286 -11.448 -35.529 1.00 1.11 H new ATOM 0 HZ3 LYS A 101 7.370 -10.041 -35.280 1.00 1.11 H new ATOM 1603 N THR A 102 6.789 -9.087 -27.792 1.00 31.40 N ATOM 1604 CA THR A 102 7.451 -8.846 -26.516 1.00 74.40 C ATOM 1605 C THR A 102 6.444 -8.461 -25.439 1.00 35.15 C ATOM 1606 O THR A 102 6.784 -8.378 -24.258 1.00 71.31 O ATOM 1607 CB THR A 102 8.510 -7.734 -26.634 1.00 30.42 C ATOM 1608 OG1 THR A 102 9.151 -7.533 -25.369 1.00 41.44 O ATOM 1609 CG2 THR A 102 7.878 -6.432 -27.101 1.00 73.01 C ATOM 0 H THR A 102 6.341 -8.265 -28.197 1.00 31.40 H new ATOM 0 HA THR A 102 7.943 -9.777 -26.234 1.00 74.40 H new ATOM 0 HB THR A 102 9.251 -8.044 -27.371 1.00 30.42 H new ATOM 0 HG1 THR A 102 8.558 -7.836 -24.650 1.00 41.44 H new ATOM 0 HG21 THR A 102 8.645 -5.662 -27.177 1.00 73.01 H new ATOM 0 HG22 THR A 102 7.416 -6.581 -28.077 1.00 73.01 H new ATOM 0 HG23 THR A 102 7.119 -6.119 -26.384 1.00 73.01 H new ATOM 1617 N TYR A 103 5.203 -8.227 -25.852 1.00 31.25 N ATOM 1618 CA TYR A 103 4.146 -7.849 -24.921 1.00 2.21 C ATOM 1619 C TYR A 103 3.883 -8.964 -23.913 1.00 53.52 C ATOM 1620 O TYR A 103 3.919 -8.743 -22.702 1.00 32.12 O ATOM 1621 CB TYR A 103 2.861 -7.520 -25.682 1.00 71.23 C ATOM 1622 CG TYR A 103 1.970 -6.530 -24.967 1.00 51.33 C ATOM 1623 CD1 TYR A 103 1.606 -6.724 -23.641 1.00 34.22 C ATOM 1624 CD2 TYR A 103 1.493 -5.398 -25.618 1.00 63.44 C ATOM 1625 CE1 TYR A 103 0.791 -5.822 -22.984 1.00 61.21 C ATOM 1626 CE2 TYR A 103 0.680 -4.490 -24.969 1.00 75.21 C ATOM 1627 CZ TYR A 103 0.331 -4.707 -23.652 1.00 51.33 C ATOM 1628 OH TYR A 103 -0.479 -3.805 -23.001 1.00 74.12 O ATOM 0 H TYR A 103 4.904 -8.292 -26.825 1.00 31.25 H new ATOM 0 HA TYR A 103 4.475 -6.963 -24.378 1.00 2.21 H new ATOM 0 HB2 TYR A 103 3.121 -7.120 -26.662 1.00 71.23 H new ATOM 0 HB3 TYR A 103 2.303 -8.441 -25.852 1.00 71.23 H new ATOM 0 HD1 TYR A 103 1.966 -7.595 -23.114 1.00 34.22 H new ATOM 0 HD2 TYR A 103 1.763 -5.226 -26.649 1.00 63.44 H new ATOM 0 HE1 TYR A 103 0.516 -5.989 -21.953 1.00 61.21 H new ATOM 0 HE2 TYR A 103 0.319 -3.615 -25.489 1.00 75.21 H new ATOM 0 HH TYR A 103 -0.006 -3.443 -22.223 1.00 74.12 H new ATOM 1638 N LEU A 104 3.618 -10.162 -24.422 1.00 43.33 N ATOM 1639 CA LEU A 104 3.349 -11.313 -23.568 1.00 61.43 C ATOM 1640 C LEU A 104 4.619 -11.774 -22.860 1.00 33.34 C ATOM 1641 O LEU A 104 4.575 -12.216 -21.711 1.00 41.02 O ATOM 1642 CB LEU A 104 2.767 -12.461 -24.395 1.00 65.41 C ATOM 1643 CG LEU A 104 3.620 -12.941 -25.571 1.00 15.41 C ATOM 1644 CD1 LEU A 104 3.897 -14.432 -25.457 1.00 12.55 C ATOM 1645 CD2 LEU A 104 2.933 -12.624 -26.891 1.00 53.23 C ATOM 0 H LEU A 104 3.584 -10.361 -25.422 1.00 43.33 H new ATOM 0 HA LEU A 104 2.623 -11.013 -22.813 1.00 61.43 H new ATOM 0 HB2 LEU A 104 2.590 -13.307 -23.731 1.00 65.41 H new ATOM 0 HB3 LEU A 104 1.796 -12.149 -24.780 1.00 65.41 H new ATOM 0 HG LEU A 104 4.573 -12.413 -25.543 1.00 15.41 H new ATOM 0 HD11 LEU A 104 4.505 -14.755 -26.302 1.00 12.55 H new ATOM 0 HD12 LEU A 104 4.431 -14.633 -24.528 1.00 12.55 H new ATOM 0 HD13 LEU A 104 2.954 -14.978 -25.459 1.00 12.55 H new ATOM 0 HD21 LEU A 104 3.553 -12.972 -27.717 1.00 53.23 H new ATOM 0 HD22 LEU A 104 1.966 -13.125 -26.927 1.00 53.23 H new ATOM 0 HD23 LEU A 104 2.787 -11.547 -26.976 1.00 53.23 H new ATOM 1657 N ASP A 105 5.748 -11.667 -23.551 1.00 0.43 N ATOM 1658 CA ASP A 105 7.031 -12.069 -22.987 1.00 21.25 C ATOM 1659 C ASP A 105 7.333 -11.288 -21.712 1.00 3.14 C ATOM 1660 O ASP A 105 7.681 -11.869 -20.682 1.00 55.33 O ATOM 1661 CB ASP A 105 8.150 -11.857 -24.007 1.00 43.31 C ATOM 1662 CG ASP A 105 8.645 -13.160 -24.604 1.00 0.25 C ATOM 1663 OD1 ASP A 105 9.341 -13.913 -23.890 1.00 50.22 O ATOM 1664 OD2 ASP A 105 8.336 -13.427 -25.783 1.00 75.03 O ATOM 0 H ASP A 105 5.801 -11.305 -24.503 1.00 0.43 H new ATOM 0 HA ASP A 105 6.974 -13.129 -22.738 1.00 21.25 H new ATOM 0 HB2 ASP A 105 7.791 -11.208 -24.806 1.00 43.31 H new ATOM 0 HB3 ASP A 105 8.982 -11.342 -23.527 1.00 43.31 H new ATOM 1669 N LEU A 106 7.200 -9.968 -21.787 1.00 62.31 N ATOM 1670 CA LEU A 106 7.460 -9.106 -20.639 1.00 71.33 C ATOM 1671 C LEU A 106 6.532 -9.450 -19.479 1.00 35.11 C ATOM 1672 O LEU A 106 6.849 -9.189 -18.319 1.00 12.01 O ATOM 1673 CB LEU A 106 7.285 -7.638 -21.030 1.00 12.45 C ATOM 1674 CG LEU A 106 8.484 -6.726 -20.767 1.00 12.30 C ATOM 1675 CD1 LEU A 106 8.955 -6.865 -19.328 1.00 0.33 C ATOM 1676 CD2 LEU A 106 9.616 -7.042 -21.734 1.00 12.34 C ATOM 0 H LEU A 106 6.914 -9.471 -22.631 1.00 62.31 H new ATOM 0 HA LEU A 106 8.489 -9.270 -20.317 1.00 71.33 H new ATOM 0 HB2 LEU A 106 7.045 -7.592 -22.092 1.00 12.45 H new ATOM 0 HB3 LEU A 106 6.425 -7.239 -20.491 1.00 12.45 H new ATOM 0 HG LEU A 106 8.173 -5.694 -20.927 1.00 12.30 H new ATOM 0 HD11 LEU A 106 9.809 -6.209 -19.160 1.00 0.33 H new ATOM 0 HD12 LEU A 106 8.146 -6.589 -18.652 1.00 0.33 H new ATOM 0 HD13 LEU A 106 9.249 -7.898 -19.139 1.00 0.33 H new ATOM 0 HD21 LEU A 106 10.461 -6.384 -21.533 1.00 12.34 H new ATOM 0 HD22 LEU A 106 9.925 -8.079 -21.606 1.00 12.34 H new ATOM 0 HD23 LEU A 106 9.273 -6.890 -22.757 1.00 12.34 H new ATOM 1688 N ALA A 107 5.384 -10.039 -19.800 1.00 64.22 N ATOM 1689 CA ALA A 107 4.412 -10.423 -18.784 1.00 50.04 C ATOM 1690 C ALA A 107 4.413 -11.932 -18.566 1.00 30.12 C ATOM 1691 O ALA A 107 3.361 -12.572 -18.583 1.00 64.03 O ATOM 1692 CB ALA A 107 3.022 -9.946 -19.178 1.00 12.44 C ATOM 0 H ALA A 107 5.105 -10.260 -20.756 1.00 64.22 H new ATOM 0 HA ALA A 107 4.696 -9.947 -17.846 1.00 50.04 H new ATOM 0 HB1 ALA A 107 2.306 -10.239 -18.411 1.00 12.44 H new ATOM 0 HB2 ALA A 107 3.024 -8.860 -19.276 1.00 12.44 H new ATOM 0 HB3 ALA A 107 2.739 -10.396 -20.130 1.00 12.44 H new ATOM 1698 N ARG A 108 5.599 -12.495 -18.361 1.00 4.23 N ATOM 1699 CA ARG A 108 5.737 -13.930 -18.141 1.00 13.54 C ATOM 1700 C ARG A 108 7.195 -14.305 -17.896 1.00 43.14 C ATOM 1701 O ARG A 108 7.502 -15.090 -16.999 1.00 53.52 O ATOM 1702 CB ARG A 108 5.193 -14.706 -19.342 1.00 5.41 C ATOM 1703 CG ARG A 108 4.458 -15.980 -18.961 1.00 55.14 C ATOM 1704 CD ARG A 108 3.149 -15.676 -18.250 1.00 14.14 C ATOM 1705 NE ARG A 108 2.658 -16.824 -17.493 1.00 33.34 N ATOM 1706 CZ ARG A 108 3.246 -17.287 -16.395 1.00 61.12 C ATOM 1707 NH1 ARG A 108 4.341 -16.702 -15.929 1.00 12.00 N ATOM 1708 NH2 ARG A 108 2.739 -18.337 -15.762 1.00 3.14 N ATOM 0 H ARG A 108 6.479 -11.979 -18.343 1.00 4.23 H new ATOM 0 HA ARG A 108 5.159 -14.194 -17.255 1.00 13.54 H new ATOM 0 HB2 ARG A 108 4.518 -14.061 -19.905 1.00 5.41 H new ATOM 0 HB3 ARG A 108 6.020 -14.958 -20.006 1.00 5.41 H new ATOM 0 HG2 ARG A 108 4.259 -16.568 -19.857 1.00 55.14 H new ATOM 0 HG3 ARG A 108 5.092 -16.588 -18.315 1.00 55.14 H new ATOM 0 HD2 ARG A 108 3.290 -14.831 -17.576 1.00 14.14 H new ATOM 0 HD3 ARG A 108 2.399 -15.377 -18.983 1.00 14.14 H new ATOM 0 HE ARG A 108 1.817 -17.297 -17.825 1.00 33.34 H new ATOM 0 HH11 ARG A 108 4.734 -15.895 -16.414 1.00 12.00 H new ATOM 0 HH12 ARG A 108 4.791 -17.059 -15.086 1.00 12.00 H new ATOM 0 HH21 ARG A 108 1.897 -18.790 -16.118 1.00 3.14 H new ATOM 0 HH22 ARG A 108 3.191 -18.692 -14.919 1.00 3.14 H new ATOM 1722 N GLN A 109 8.089 -13.739 -18.701 1.00 63.41 N ATOM 1723 CA GLN A 109 9.515 -14.016 -18.573 1.00 21.24 C ATOM 1724 C GLN A 109 10.083 -13.371 -17.313 1.00 5.00 C ATOM 1725 O GLN A 109 11.010 -13.898 -16.698 1.00 4.01 O ATOM 1726 CB GLN A 109 10.268 -13.509 -19.804 1.00 14.21 C ATOM 1727 CG GLN A 109 10.444 -11.999 -19.830 1.00 24.24 C ATOM 1728 CD GLN A 109 10.590 -11.452 -21.236 1.00 61.50 C ATOM 1729 OE1 GLN A 109 10.700 -12.210 -22.201 1.00 12.04 O ATOM 1730 NE2 GLN A 109 10.592 -10.130 -21.360 1.00 72.43 N ATOM 0 H GLN A 109 7.851 -13.086 -19.448 1.00 63.41 H new ATOM 0 HA GLN A 109 9.644 -15.096 -18.497 1.00 21.24 H new ATOM 0 HB2 GLN A 109 11.250 -13.982 -19.839 1.00 14.21 H new ATOM 0 HB3 GLN A 109 9.732 -13.820 -20.701 1.00 14.21 H new ATOM 0 HG2 GLN A 109 9.586 -11.529 -19.349 1.00 24.24 H new ATOM 0 HG3 GLN A 109 11.324 -11.730 -19.246 1.00 24.24 H new ATOM 0 HE21 GLN A 109 10.498 -9.540 -20.533 1.00 72.43 H new ATOM 0 HE22 GLN A 109 10.687 -9.704 -22.282 1.00 72.43 H new ATOM 1739 N SER A 110 9.522 -12.227 -16.935 1.00 30.10 N ATOM 1740 CA SER A 110 9.976 -11.507 -15.751 1.00 32.43 C ATOM 1741 C SER A 110 9.258 -12.009 -14.502 1.00 33.34 C ATOM 1742 O SER A 110 9.777 -11.909 -13.391 1.00 12.22 O ATOM 1743 CB SER A 110 9.740 -10.005 -15.919 1.00 62.23 C ATOM 1744 OG SER A 110 10.966 -9.311 -16.074 1.00 11.14 O ATOM 0 H SER A 110 8.752 -11.779 -17.432 1.00 30.10 H new ATOM 0 HA SER A 110 11.044 -11.689 -15.633 1.00 32.43 H new ATOM 0 HB2 SER A 110 9.106 -9.828 -16.788 1.00 62.23 H new ATOM 0 HB3 SER A 110 9.206 -9.618 -15.051 1.00 62.23 H new ATOM 0 HG SER A 110 10.788 -8.353 -16.181 1.00 11.14 H new ATOM 1750 N GLY A 111 8.058 -12.551 -14.693 1.00 44.33 N ATOM 1751 CA GLY A 111 7.287 -13.060 -13.575 1.00 23.45 C ATOM 1752 C GLY A 111 8.068 -14.054 -12.737 1.00 11.31 C ATOM 1753 O GLY A 111 9.013 -14.676 -13.221 1.00 4.22 O ATOM 0 H GLY A 111 7.607 -12.646 -15.603 1.00 44.33 H new ATOM 0 HA2 GLY A 111 6.972 -12.228 -12.946 1.00 23.45 H new ATOM 0 HA3 GLY A 111 6.381 -13.537 -13.949 1.00 23.45 H new TER 1757 GLY A 111